SCHEMBL9765340

SCHEMBL9765340

CCOC(=O)/C=C(/C)c1ccc(OC)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
TAS1R3 Q7RTX0 7/20 0.48
TAS1R1 Q7RTX1 7/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B2 P37059 1/20 0.43
FDPS P14324 1/20 0.42
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
ADRB2 P07550 1/20 0.41
GAA P10253 1/20 0.41
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
PRSS1 P07477 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
SCHEMBL9765327 1.00 ALDH1A1 (0.52) ALDH1A1MAPTTAS1R3TAS1R1SMN1; SMN2
SCHEMBL9765325 1.00 ALDH1A1 (0.52) ALDH1A1MAPTTAS1R3TAS1R1SMN1; SMN2
SCHEMBL10611120 0.87 MAPK1 (0.52) ALDH1A1MAPTSMN1; SMN2HSD17B2FDPS
SCHEMBL10611123 0.87 MAPK1 (0.52) ALDH1A1MAPTSMN1; SMN2HSD17B2FDPS
SCHEMBL4154987 0.86 TSHR (0.46) ALDH1A1MAPTSMN1; SMN2HPGDNPSR1
SCHEMBL4154989 0.86 TSHR (0.46) ALDH1A1MAPTSMN1; SMN2HPGDNPSR1
SCHEMBL4154993 0.86 TSHR (0.46) ALDH1A1MAPTSMN1; SMN2HPGDNPSR1
SCHEMBL9514114 0.84 HTT (0.54) ALDH1A1MAPTTAS1R3TAS1R1HSD17B2
SCHEMBL9514123 0.84 HTT (0.54) ALDH1A1MAPTTAS1R3TAS1R1HSD17B2
SCHEMBL28517911 0.80 F2 (0.42) ALDH1A1MAPTSMN1; SMN2PKMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255728-B1 PHENOXYACETIC ACID COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITION AND USE TANABE SEIYAKU CO., LTD. (JP) 1991-11-27 EP disclosed
US-4866196-A ANTICOAGULANTS TANABE SEIYAKU CO., LTD. (JP) 1989-09-12 US disclosed