SCHEMBL9692298

SCHEMBL9692298

CCCCCCCCCCCCCCCCCCCCOc1ccsc1.CCCCCCCCCCCCCCCCCCOc1ccsc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.52
TP53 P04637 3/20 0.46
TSHR P16473 2/20 0.46
LTA4H P09960 3/20 0.46
PLA2G4B P0C869 2/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 1/20 0.43
RARB P10826 3/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PLA2G2A P14555 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
PLA2G4A P47712 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
SCHEMBL148732 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL146912 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9509042 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL151173 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9511511 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9511449 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9508223 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9579049 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL2744591 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B
SCHEMBL9510201 1.00 NR5A1 (0.52) NR5A1TP53TSHRLTA4HPLA2G4B

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-5098529-A ELECTROCHEMICAL PROCESS FOR THE PRODUCTION OF ELECTRICALLY CONDUCTING POLY(ALKOXYTHIOPHENES) WITH CARBOXYLIC ACIDS ADDED HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-24 US disclosed