SCHEMBL23903545

SCHEMBL23903545

CCc1ccc(Cc2ccc(O)cc2F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
ALOX5 P09917 3/20 0.49
TYR P14679 4/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
ALOX15 P16050 2/20 0.40
CHRNA7 P36544 1/20 0.40
APAF1 O14727 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
BLM P54132 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL22214947 0.86 MAPT (0.50) MEN1MAPTKMT2AALOX5TYR
SCHEMBL25625593 0.82 MAPT (0.50) MEN1MAPTKMT2AALOX5TYR
SCHEMBL22965747 0.81 MEN1 (0.50) MEN1MAPTKMT2AALOX5TYR
SCHEMBL310196 0.81 CHRNA7 (0.50) MEN1MAPTKMT2AALOX5TYR
SCHEMBL18121258 0.79 MAPT (0.61) MEN1MAPTKMT2AALOX5TYR
SCHEMBL3794781 0.79 MAPT (0.54) MEN1MAPTKMT2AALOX5ESR1
SCHEMBL14998892 0.78 MAPT (0.50) MEN1MAPTKMT2AALOX5TYR
SCHEMBL18121257 0.76 ALOX5 (0.55) MEN1MAPTKMT2AALOX5TYR
SCHEMBL1509942 0.75 ESR1 (0.56) ESR1ESR2CYP3A4
SCHEMBL4055779 0.74 MAPT (0.81) MEN1MAPTKMT2AALOX5TYR

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
WO-2021203016-A2 PROTEIN-PROTEIN INTERACTION STABILIZERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-07 WO disclosed