SCHEMBL9707019

SCHEMBL9707019

CC(C)(Cc1ccc(O)cc1)NS(=O)(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
ATM Q13315 2/20 0.49
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
GLA P06280 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ESR1 P03372 1/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
BLM P54132 1/20 0.44
CYP2C19 P33261 1/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
GHSR Q92847 1/20 0.42
LMNA P02545 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYTH2 Q99418 1/20 0.42

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
SCHEMBL9765279 0.85 TSHR (0.55) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL7984128 0.84 BLM (0.48) ALDH1A1ATMKDM4ETDP1MAPT
SCHEMBL7984126 0.84 BLM (0.48) ALDH1A1ATMKDM4ETDP1MAPT
SCHEMBL1479993 0.80 ALDH1A1 (0.56) ALDH1A1ATMKDM4ETDP1GLA
SCHEMBL6820712 0.80 ATM (0.58) ALDH1A1ATMKDM4ETDP1MAPT
SCHEMBL9765329 0.76 MEN1 (0.51) ALDH1A1SMN1; SMN2ESR1KMT2AMEN1
SCHEMBL5812323 0.75 PARG (0.62) ALDH1A1ATMKDM4ETDP1GLA
SCHEMBL9513604 0.75 ESR2 (0.50) ALDH1A1SMN1; SMN2ESR1KMT2AMEN1
SCHEMBL24174301 0.74 ALDH1A1 (0.43) ALDH1A1ATMKDM4EMAPTSMN1; SMN2
SCHEMBL11032086 0.74 ALDH1A1 (0.56) ALDH1A1ATMKDM4ETDP1GLA

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
EP-0502498-A1 Phenoxyalkanoic acid derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1992-09-09 EP disclosed