SCHEMBL11209094

SCHEMBL11209094

O=C(c1ccc(O)cc1C(F)(F)F)c1ccc(O)cc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.50
ESRRG P62508 1/20 0.47
HSD17B3 P37058 1/20 0.42
CA12 O43570 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 2/20 0.40
NFE2L2 Q16236 2/20 0.40
KIF11 P52732 1/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
KEAP1 Q14145 1/20 0.40
P2RX1 P51575 1/20 0.39
ATM Q13315 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
SCHEMBL11207864 0.89 MAPT (0.48) CES2ESRRGALDH1A1KMT2ANFE2L2
SCHEMBL187787 0.88 ALDH1A1 (0.57) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL11210255 0.86 MEN1 (0.62) CES2ALDH1A1TSHRKMT2ANFE2L2
SCHEMBL13885066 0.84 KMT2A (0.49) CES2ESRRGALDH1A1KMT2ANFE2L2
SCHEMBL24177167 0.84 CES2 (0.47) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL323569 0.84 ESRRG (0.48) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL25387702 0.84 CES2 (0.47) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL31252817 0.84 ESRRG (0.48) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL29789661 0.84 CES2 (0.47) CES2ESRRGHSD17B3CA12ALDH1A1
SCHEMBL26019641 0.81 ESRRG (0.52) CES2ESRRGHSD17B3CA12ALDH1A1

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-4329360-A Benzophenones and their use as fungicides GAF CORPORATION (US) 1982-05-11 US disclosed