SCHEMBL3424995

SCHEMBL3424995

O=c1cc(-c2ccccc2)n(-c2ccccc2)c(-c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
LMNA P02545 4/20 0.55
HTT P42858 3/20 0.55
ALDH1A1 P00352 3/20 0.55
CYP2C9 P11712 1/20 0.47
POLB P06746 1/20 0.46
PLK1 P53350 1/20 0.46
GSK3A P49840 3/20 0.45
GSK3B P49841 3/20 0.45
GAA P10253 3/20 0.45
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPK1 P28482 1/20 0.43
PTPN5 P54829 1/20 0.42
MDM2 Q00987 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FAAH O00519 1/20 0.41
HSP90AA1 P07900 1/20 0.41
PKM P14618 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
SCHEMBL11310071 0.79 MAPT (0.52) TSHRLMNAHTTALDH1A1GSK3A
SCHEMBL1573850 0.76 TSHR (0.50) TSHRLMNAHTTALDH1A1CYP2C9
SCHEMBL11436206 0.76 ALDH1A1 (0.56) LMNAHTTALDH1A1HPGDKMT2A
SCHEMBL10722294 0.75 ALDH1A1 (0.51) TSHRLMNAHTTALDH1A1POLB
SCHEMBL10513428 0.74 ALDH1A1 (0.50) TSHRLMNAHTTALDH1A1HPGD
SCHEMBL28513461 0.74 MAPK1 (0.53) TSHRLMNAHTTALDH1A1CYP2C9
SCHEMBL30160665 0.74 MAPK1 (0.53) TSHRLMNAHTTALDH1A1CYP2C9
SCHEMBL9372800 0.74 TSHR (0.47) TSHRLMNAHTTALDH1A1CYP2C9
SCHEMBL10724548 0.74 TSHR (0.55) TSHRLMNAHTTALDH1A1CYP2C9
SCHEMBL10059751 0.72 TSHR (0.46) TSHRLMNAHTTALDH1A1CYP2C9

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119331133-B Catalyst component for olefin polymerization, catalyst for olefin polymerization and application thereof 中国石油天然气股份有限公司 2026-05-15 CN claimed
JP-2085213-A None JP disclosed
US-20100160385-A1 FUNGICIDAL TRIPHENYL-SUBSTITUTED PYRIDONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-24 US disclosed
EP-0304057-B1 Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO (JP) 1994-04-20 EP disclosed
EP-0239391-B1 1,2,6-triphenyl-4(1H)-pyridinone and pyridinethione derivatives, production and uses thereof KUMIAI CHEMICAL INDUSTRY CO (JP) 1994-03-02 EP disclosed
JP-H0285213-A ANTIBACTERIAL AND ANTIFUNGAL AGENT IHARA CHEM IND CO LTD 1990-03-26 JP disclosed
US-4871751-A 1,2,6-Triphenyl-4(1H)-pyridinone derivatives, and their use as fungicides KUMAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-10-03 US disclosed
US-4871751-A 1,2,6-Triphenyl-4(1H)-pyridinone derivatives, and their use as fungicides KUMAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-10-03 US disclosed
US-4757081-A Agriculture, horticulture KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-12 US disclosed
US-4757081-A Agriculture, horticulture KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-12 US disclosed
EP-0239391-A2 1,2,6-triphenyl-4(1H)-pyridinone and pyridinethione derivatives, production and uses thereof KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-09-30 EP disclosed
EP-0239391-A2 1,2,6-triphenyl-4(1H)-pyridinone and pyridinethione derivatives, production and uses thereof KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-09-30 EP 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 (1 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-20100160385-A1 FUNGICIDAL TRIPHENYL-SUBSTITUTED PYRIDONES PNPO, TH, CYP1A1 TSHR 2034/4885LMNA 4073/4885HTT 4198/4885

“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.