SCHEMBL615456

SCHEMBL615456

CCC=Cc1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD2 O60906 2/20 0.51
CHAT P28329 5/20 0.50
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
RXRA P19793 1/20 0.49
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GRIK1 P39086 1/20 0.46
GRIK2 Q13002 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL615455 1.00 SMPD2 (0.51) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1469842 0.85 TLR8 (0.50) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1469843 0.85 TLR8 (0.50) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL30786727 0.83 ALDH1A1 (0.41) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1469100 0.83 ALDH1A1 (0.41) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1469098 0.83 ALDH1A1 (0.41) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1468842 0.82 CHAT (0.52) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL1468841 0.82 CHAT (0.52) SMPD2CHATMTNR1AMTNR1BRXRA
SCHEMBL133603 0.81 CHAT (0.46) CHATMTNR1AMTNR1BRXRAPTGS1
SCHEMBL6001652 0.81 CHAT (0.40) SMPD2CHATMTNR1AMTNR1BRXRA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 146 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105714-B2 Phosphonium salt formation from a phosphine and a carbonium compound, ball milling to form the phosphorus ylide, phosphorylation of an aldehyde or ketone; one pot process; improved catalyst selectivity, efficiency; low temperature, industrial scale IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2006-09-12 US claimed
US-20040260128-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2004-12-23 US claimed
US-20030176740-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2003-09-18 US claimed
WO-2003066548-A2 SOLVENT-FREE MECHANOCHEMICAL PREPARATION OF PHOSPHONIUM SALTS, PHOSPHORUS YLIDES, AND OLEFINS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2003-08-14 WO claimed
US-20260138110-A1 HOLLOW PARTICLES, METHOD FOR PRODUCING HOLLOW PARTICLES, RESIN COMPOSITION, MOLDED BODY AND METHOD FOR PRODUCING MOLDED BODY WATANABE MASASHI (JP) 2026-05-21 US disclosed
US-20260098143-A1 RESIN COMPOSITION, AND PREPREG, RESIN-EQUIPPED FILM, RESIN-EQUIPPED METAL FOIL, METAL-CLAD LAMINATED PLATE, AND WIRING BOARD USING SAID RESIN COMPOSITION PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2026-04-09 US disclosed
EP-4722290-A1 FLUORORUBBER COMPOSITION AND CROSSLINKED MOLDED OBJECT FORMED THEREFROM Zeon Corporation (JP) 2026-04-08 EP disclosed
EP-4714536-A2 HOLLOW PARTICLES, METHOD FOR PRODUCING HOLLOW PARTICLES, RESIN COMPOSITION, MOLDED BODY AND METHOD FOR PRODUCING MOLDED BODY Zeon Corporation (JP) 2026-03-25 EP disclosed
US-20260078253-A1 RESIN COMPOSITION, AND PREPREG, FILM WITH RESIN, METAL FOIL WITH RESIN, METAL-CLAD LAMINATED PLATE, AND WIRING BOARD USING SAME PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2026-03-19 US disclosed
US-20260078240-A1 HOLLOW PARTICLES, RESIN COMPOSITION AND MOLDED BODY ZEON CORPORATION (JP) 2026-03-19 US disclosed
EP-3875528-B1 USE OF A RUBBER COMPOSITION IN A PNEUMATIC TIRE ZEON CORP (JP) 2026-01-14 EP disclosed
EP-4674915-A1 RESIN COMPOSITION, PREPREG, AND MOLDED OBJECT Zeon Corporation (JP) 2026-01-07 EP disclosed
US-7105714-B2 Phosphonium salt formation from a phosphine and a carbonium compound, ball milling to form the phosphorus ylide, phosphorylation of an aldehyde or ketone; one pot process; improved catalyst selectivity, efficiency; low temperature, industrial scale IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2006-09-12 US disclosed
US-20060177666-A1 Curable resin compositions NIPPON STEEL CHEMICAL CO., LTD. (JP) 2006-08-10 US disclosed
US-20040260128-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2004-12-23 US disclosed
US-6730812-B2 BALL-MILLING AND SALT FORMATION, CATALYTIC REACTION IN ONE POT; CATALYST SELECTIVITY, EFFICIENCY, LOW TEMPERATURE, SIMPLIFICATION; FORMING UNSATURATED COMPOUNDS, 4-BROMOSTYRENE, ISOPROPENYLNAPHTHALENE/1-/ IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2004-05-04 US disclosed
US-20030176740-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2003-09-18 US disclosed
WO-2003066548-A2 SOLVENT-FREE MECHANOCHEMICAL PREPARATION OF PHOSPHONIUM SALTS, PHOSPHORUS YLIDES, AND OLEFINS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2003-08-14 WO disclosed
US-5030784-A Process for converting lower-alkyl substituted aromatic compounds and butadiene to 4-aryl-1-butene or 4-aryl-1-pentene and propylene SHELL OIL COMPANY (US) 1991-07-09 US disclosed
US-4258171-A Polyphosphazene polymers containing substituted alkyl/cycloalkyl substituents THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-03-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260078240-A1 HOLLOW PARTICLES, RESIN COMPOSITION AND MOLDED BODY ARID2, BRWD1, WDR1 SMPD2 4565/4885CHAT 4754/4885MTNR1A 4648/4885
US-20260098143-A1 RESIN COMPOSITION, AND PREPREG, RESIN-EQUIPPED FILM, RESIN-EQUIPPED METAL FOIL, METAL-CLAD LAMINATED PLATE, AND WIRING BOARD USING SAID RESIN COMPOSITION VMA21, ARCN1, RAD51 SMPD2 4338/4885CHAT 3503/4885MTNR1A 1709/4885
US-20040260128-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins CCR4, CCR1, CCR6 SMPD2 2988/4885CHAT 4484/4885MTNR1A 2257/4885
US-20030176740-A1 Solvent-free mechanochemical preparation of phosphonium salts, phosphorus ylides, and olefins CCR4, CCR1, CCR6 SMPD2 2988/4885CHAT 4484/4885MTNR1A 2257/4885
US-20260078253-A1 RESIN COMPOSITION, AND PREPREG, FILM WITH RESIN, METAL FOIL WITH RESIN, METAL-CLAD LAMINATED PLATE, AND WIRING BOARD USING SAME ARCN1, TGFBR1, C1R SMPD2 4856/4885CHAT 2858/4885MTNR1A 1017/4885
US-20260138110-A1 HOLLOW PARTICLES, METHOD FOR PRODUCING HOLLOW PARTICLES, RESIN COMPOSITION, MOLDED BODY AND METHOD FOR PRODUCING MOLDED BODY SEM1, DAP3, HAO2 SMPD2 3909/4885CHAT 4598/4885MTNR1A 3398/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.