SCHEMBL4632446

SCHEMBL4632446

C=Cc1ccccc1CCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 0.50
HTR2A P28223 5/20 0.45
ALDH1A1 P00352 1/20 0.41
HRH1 P35367 2/20 0.41
CYP2A6 P11509 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
MPO P05164 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
HTR2C P28335 1/20 0.37
HTR7 P34969 1/20 0.37
CTSK P43235 1/20 0.37
HTR6 P50406 1/20 0.37
CYP2A13 Q16696 1/20 0.37
PMP22 Q01453 1/20 0.36

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
SCHEMBL595200 0.86 ALDH1A1 (0.48) TAAR1ALDH1A1CYP1A2
SCHEMBL29377653 0.86 ALDH1A1 (0.48) TAAR1ALDH1A1CYP1A2
SCHEMBL24133067 0.86 MAOA (0.45) TAAR1ALDH1A1HRH1MPO
SCHEMBL5072509 0.84 ALDH1A1 (0.46) TAAR1HTR2AALDH1A1CYP1A2
SCHEMBL263092 0.82 PNMT (0.44) TAAR1ALDH1A1CYP2A6SMN1; SMN2LOXL2
SCHEMBL6284419 0.82 ALDH1A1 (0.44) ALDH1A1MPOCYP3A4CYP2D6
SCHEMBL6278153 0.82 ALDH1A1 (0.44) ALDH1A1MPOCYP3A4CYP2D6
SCHEMBL31054112 0.82 ALDH1A1 (0.44) ALDH1A1MPOCYP3A4CYP2D6
Hydrochloric Acid SCHEMBL9624664 0.80 PNMT (0.43) TAAR1ALDH1A1CYP2A6SMN1; SMN2LOXL2
SCHEMBL6278393 0.80 ALDH1A1 (0.43) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57063317-A None JP disclosed
US-9447148-B2 Melanocortin-1 receptor-specific cyclic peptides PALATIN TECHNOLOGIES, INC. (US) 2016-09-20 US disclosed
US-20150038434-A1 Melanocortin-1 Receptor-Specific Cyclic Peptides PALATIN TECHNOLOGIES INC (US) 2015-02-05 US disclosed
US-8877890-B2 Melanocortin-1 receptor-specific cyclic peptides PALATIN TECHNOLOGIES, INC. (US) 2014-11-04 US disclosed
US-20130296256-A1 Melanocortin-1 Receptor-Specific Cyclic Peptides PALATIN TECHNOLOGIES, INC. (US) 2013-11-07 US disclosed
CN-102382258-A Conjugated diene-based polymer, conjugated diene-based polymer composition, and process for producing conjugated diene-based polymer SUMITOMO CHEMICAL CO 2012-03-21 CN disclosed
CN-101085844-B Thermoplastic elastomer composition and method for producing same JSR CORP 2011-07-20 CN disclosed
CN-101080455-B Flame-retardant resin composition and molded article using same FURUKAWA ELECTRIC CO LTD 2011-06-01 CN disclosed
CN-1657652-B Surface conditioner and method of surface conditioning NIPPON PAINT CO LTD 2011-05-11 CN disclosed
CN-101080456-B Flame-retardant resin composition and formed article using the same FURUKAWA ELECTRIC CO LTD 2011-02-23 CN disclosed
CN-1130383-C Hydrogenizing method for conjugate diene polymer and its adaptive catalyst composition SHELL INT RESEARCH (NL) 2003-12-10 CN disclosed
US-6558873-B1 Interlayer containing a compound capable of forming a complex with aluminum and a photopolymerizable photosensitive layer containing a photopolymerization initiator, an addition polymerizable compound capable of complexing with aluminum FUJI PHOTO FILM CO., LTD. (JP) 2003-05-06 US disclosed
CN-1394210-A Hydrogenated polymers ASAHI CHEMICAL IND (JP) 2003-01-29 CN disclosed
CN-1317514-A Fire retardant thermoplastic resin compsns. TAKANON RESIN CO LTD (JP) 2001-10-17 CN disclosed
EP-1091251-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
CN-1163275-A Hydrogenizing method for conjugate diene polymer and its adaptive catalyst composition SHELL INT RESEARCH (NL) 1997-10-29 CN disclosed
US-5009949-A Resin impregnated substrate HITACHI CHEMICAL COMPANY, LTD. (JP) 1991-04-23 US disclosed
EP-0293112-A2 Resin composition and electrical laminate obtained therefrom Hitachi Chemical Co., Ltd. (JP) 1988-11-30 EP disclosed
JP-S5763317-A NOVEL GRAFT POLYMER AND ITS PRODUCTION TSURUTA TEIJI 1982-04-16 JP disclosed
JP-S05763317-A 0001-01-01 JP 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 (2 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-20150038434-A1 Melanocortin-1 Receptor-Specific Cyclic Peptides MC1R, MC3R, MC5R TAAR1 103/4885HTR2A 336/4885ALDH1A1 3868/4885
US-20130296256-A1 Melanocortin-1 Receptor-Specific Cyclic Peptides MC1R, MC3R, MC5R TAAR1 103/4885HTR2A 336/4885ALDH1A1 3868/4885

“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.