SCHEMBL10619002

SCHEMBL10619002

C[C@@H]1SC(=O)N[C@H]1c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MDM2 Q00987 3/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
FPR2 P25090 1/20 0.35
MAPT P10636 2/20 0.34
HTR3A P46098 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL10619005 1.00 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AMDM2TP53
SCHEMBL10619009 1.00 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AMDM2TP53
SCHEMBL10618890 0.80 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMDM2TP53
SCHEMBL10618877 0.80 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMDM2TP53
SCHEMBL6615271 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPK1TNKS2
SCHEMBL6615267 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPK1TNKS2
SCHEMBL6615263 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMAPK1TNKS2
SCHEMBL13567612 0.71 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMDM2TP53
SCHEMBL9211041 0.66 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AMAPK1TNKS2
SCHEMBL10783623 0.65 MEN1 (0.52) ALDH1A1MEN1KMT2AMDM2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60104096-A None JP disclosed
EP-0146748-B1 ORGANOPHOSPHORUS COMPOUND, PROCESS FOR ITS PREPARATION AND INSECTICIDAL, MITICIDAL OR NEMATICIDAL COMPOSITION CONTAINING IT ISHIHARA SANGYO KAISHA, LTD. (JP) 1988-05-04 EP disclosed
US-4590182-A Organophosphorus compound and insecticidal, miticidal or nematicidal composition containing it ISHIHARA SANGYO KAISHA LTD. (JP) 1986-05-20 US disclosed
EP-0146748-A1 Organophosphorus compound, process for its preparation and insecticidal, miticidal or nematicidal composition containing it ISHIHARA SANGYO KAISHA, LTD. (JP) 1985-07-03 EP disclosed
JP-S60104096-A ORGANIC PHOSPHORUS COMPOUND, INSECTICIDE, ACARICIDE, AND NEMATOCIDE CONTAINING IT ISHIHARA SANGYO KAISHA LTD 1985-06-08 JP disclosed