SCHEMBL10388478

SCHEMBL10388478

Cc1ccc(SCCNC(=O)CCl)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 1/20 0.73
▸ YAP1 P46937 1/20 0.73
▸ TEAD4 Q15561 1/20 0.73
▸ TEAD2 Q15562 1/20 0.73
▸ ALDH1A1 P00352 8/20 0.61
▸ HPGD P15428 7/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ LMNA P02545 3/20 0.53
▸ MAPT P10636 3/20 0.53
▸ HTT P42858 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL11492938 0.83 TEAD1 (0.73) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL11309511 0.78 HPGD (0.69) ALDH1A1HPGDCYP1A2CYP3A4CYP2C9
SCHEMBL18775352 0.78 ALDH1A1 (0.68) ALDH1A1HPGDCYP1A2CYP3A4CYP2C9
SCHEMBL8015226 0.78 ALDH1A1 (0.62) ALDH1A1HPGDCYP1A2CYP3A4CYP2C9
SCHEMBL14241835 0.75 TEAD1 (0.77) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL10388479 0.74 KDM4E (0.45) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808073 0.74 TEAD1 (0.60) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9925290 0.74 HPGD (0.62) HPGDKMT2ASMN1; SMN2LMNA
SCHEMBL10389706 0.73 NPC1 (0.67) ALDH1A1HPGDMAPK1MEN1KMT2A
SCHEMBL9808086 0.72 TEAD1 (0.58) TEAD1YAP1TEAD4TEAD2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4892952-A Substituted heteroaralkyl, heteroaralkenyl or halomethyl fungicides CHEVRON RESEARCH COMPANY (US) 1990-01-09 — — US disclosed
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