SCHEMBL11287005

SCHEMBL11287005

Nc1cc(F)cc(C(=O)c2ccc(F)cc2)c1O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.45
KEAP1 Q14145 1/20 0.44
TTR P02766 1/20 0.44
LTA4H P09960 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
NPC1 O15118 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
MAPK14 Q16539 1/20 0.38

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
SCHEMBL11288356 0.89 MAPT (0.48) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL11292931 0.89 MAPT (0.51) TTRKMT2AMAPTNPC1MAPK1
SCHEMBL11292035 0.88 MAPT (0.53) HDAC1KEAP1MEN1KMT2AMAPT
SCHEMBL11290937 0.85 KMT2A (0.45) HDAC1MEN1KMT2AMAPT
SCHEMBL11319565 0.85 MAPT (0.48) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL11287081 0.85 NPC1 (0.50) MEN1KMT2AMAPTNPC1MAPK1
SCHEMBL11296456 0.85 ALDH1A1 (0.43) MEN1KMT2AMAPTNPC1
SCHEMBL11294333 0.85 MAPT (0.49) MEN1KMT2AMAPTNPC1TSHR
SCHEMBL11294809 0.82 TDP1 (0.44) HDAC1TTRMEN1KMT2AMAPT
SCHEMBL11293489 0.81 KDM4E (0.56) KMT2AMAPTNPC1TSHRMAPK1

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-0065874-A1 2-Aminophenol derivatives, methods for their preparation and composition containing the same ONO PHARMACEUTICAL CO., LTD. (JP) 1982-12-01 EP disclosed