SCHEMBL461726

SCHEMBL461726

O=c1[nH]cnn1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
RAB9A P51151 5/20 0.46
HTT P42858 4/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
PAX8 Q06710 2/20 0.46
MITF O75030 1/20 0.46
S1PR4 O95977 1/20 0.46
THRB P10828 1/20 0.46
XBP1 P17861 1/20 0.46
S1PR1 P21453 1/20 0.46
GAA P10253 3/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
CNOT7 Q9UIV1 1/20 0.42
LMNA P02545 3/20 0.42
RXFP1 Q9HBX9 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HIF1A Q16665 1/20 0.41

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
SCHEMBL8682235 0.80 NPC1 (0.42) ALDH1A1RAB9AHTTMAPTNPC1
SCHEMBL5906335 0.80 ALDH1A1 (0.40) ALDH1A1RAB9AHTTMAPTNPC1
SCHEMBL29172956 0.80 ALDH1A1 (0.45) ALDH1A1RAB9AHTTMAPTNPC1
SCHEMBL5906196 0.80 SMN1; SMN2 (0.42) ALDH1A1RAB9AHTTMAPTNPC1
SCHEMBL30712345 0.80 MGLL (0.47) ALDH1A1GAAGSK3AGSK3BPOLB
SCHEMBL5906387 0.80 MGLL (0.44) ALDH1A1RAB9AHTTMAPTNPC1
SCHEMBL9633351 0.78 DDB1 (0.43) ALDH1A1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL5906032 0.78 ALDH1A1 (0.46) ALDH1A1MAPTGAAPOLB
SCHEMBL8775840 0.78 NPC1 (0.54) ALDH1A1RAB9AMAPTNPC1PAX8
SCHEMBL3235736 0.76 ATM (0.47) RAB9AHTTMAPTGSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301816-A1 COATING COMPOSITIONS COMPRISING A POLYSULFIDE CORROSION INHIBITOR PRC-Desoto International, Inc. (US) 2024-01-10 EP claimed
CN-117377727-A Coating composition comprising polysulfide corrosion inhibitor PRC-迪索托国际公司 2024-01-09 CN claimed
US-8669371-B2 Regioselective chlorination of the phenyl ring of 4,5-dihydro-1-phenyl-1H-1,2,4-triazol-5-ones TAGROS CHEMICALS INDIA PVT LTD (IN) 2014-03-11 US claimed
US-20130072689-A1 Regioselective chlorination of the phenyl ring of 4,5-dihydro-1-phenyl-1H-1,2,4-triazol-5-ones TAGROS CHEMICALS INDIA, LTD. (IN) 2013-03-21 US claimed
EP-1053679-A1 Herbicidal compositions AVENTIS CROPSCIENCE S.A. (FR) 2000-11-22 EP claimed
US-5756755-A Difluoromethylation of 4,5-dihydro-1-phenyl-3-methyl-1,2,4-triazol-5(1H)-ones with glymes as solvents FMC CORPORATION (US) 1998-05-26 US claimed
US-5468868-A Process for the selective chlorination of 4,5-dihydro-1-phenyl-1H-1,2,4-triazol-5-one FMC CORPORATION (US) 1995-11-21 US claimed
US-5438149-A Reacting with chlorodifluoromethane and potassium carbonate while heating in solvent of dimethylformamide, 1-methyl-2-pyrrolidone or N,N-dimethylacetamide FMC CORPORATION (US) 1995-08-01 US claimed
US-5104919-A With curing retardant or flame retardant triazole compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1992-04-14 US claimed
EP-0432212-A1 HERBICIDAL TRIAZOLINONES. FMC CORP (US) 1991-06-19 EP claimed
WO-1990002120-A1 HERBICIDAL TRIAZOLINONES FMC CORPORATION (US) 1990-03-08 WO claimed
US-12630740-B2 Compositions containing thermally conductive fillers PPG INDUSTRIES OHIO, INC. (US) 2026-05-19 US disclosed
US-12577412-B2 Corrosion inhibiting coating compositions PRC-DESOTO INTERNATIONAL, INC. (US) 2026-03-17 US disclosed
EP-4136139-B1 USE OF A COATING FORMED FROM A COMPOSITION CONTAINING THERMALLY CONDUCTIVE FILLERS TO PROVIDE A SUBSTRATE WITH THERMAL AND FIRE PROTECTION PPG IND OHIO INC (US) 2025-08-20 EP disclosed
EP-4136136-B1 CONTROLLING CURE RATE WITH WETTED FILLER PRC DESOTO INT INC (US) 2025-01-29 EP disclosed
US-4400517-A PESTICIDES; APHIDICIDES; PARASITICIDES MONTEDISON S.P.A. (IT) 1983-08-23 US disclosed
US-4310444-A POLYSILOXANES, SILICA, PLATINUM OR PLATINUM COMPOUND, FATTY ACID OR ITS SALT AND A PEROXIDE TORAY SILICONE COMPANY, LTD. (JP) 1982-01-12 US disclosed
US-4220789-A CYCLIZATION OF A SEMICARBAZONE MONTEDISON S.P.A. (IT) 1980-09-02 US disclosed
US-4156674-A PLATINUM OR COMPOUND THEREOF, CARBON BLACK AND A TRIAZOLE FOR SELF-EXTINGUISHING CHARACTER, CURING CATALYST AND A SILICON CONTAINING CROSSLINKER TORAY SILICONE COMPANY, LTD. (JP) 1979-05-29 US disclosed
US-4087399-A ORGANO-POLYSILOXANE, SILICA FILLER, PLATINUM, CARBON BLACK, TITANIUM DIOXIDE, AND TRIAZOLE COMPOUND TORAY SILICONE COMPANY, LTD. (JA) 1978-05-02 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 (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-12630740-B2 Compositions containing thermally conductive fillers ATP5MK, ITGAM, HNRNPM ALDH1A1 387/4885RAB9A 3080/4885HTT 983/4885
US-12577412-B2 Corrosion inhibiting coating compositions MGMT, MBD2, MECP2 ALDH1A1 897/4885RAB9A 2485/4885HTT 903/4885

“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.