SCHEMBL31331747

SCHEMBL31331747

CCN(c1ccc(F)cc1)c1ccc2c(C(F)(F)F)cc(=O)oc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.62
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
CASP1 P29466 2/20 0.51
CASP7 P55210 2/20 0.51
ATM Q13315 2/20 0.51
HSD17B10 Q99714 2/20 0.51
KDM4E B2RXH2 2/20 0.51
HSD17B3 P37058 1/20 0.51
GAA P10253 1/20 0.51
SRC P12931 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TLR9 Q9NR96 1/20 0.51
IGLV6-57 P01721 4/20 0.49
GLA P06280 2/20 0.49
CYP3A4 P08684 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL31331915 0.85 AR (0.61) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL29551746 0.84 AR (0.75) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL144250 0.84 AR (0.75) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331897 0.84 AR (0.62) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331847 0.81 AR (0.59) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331719 0.81 AR (0.51) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331848 0.81 AR (0.59) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331686 0.81 AR (0.59) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331728 0.81 AR (0.56) ARALDH1A1HPGDMEN1KMT2A
SCHEMBL31331708 0.80 AR (0.55) ARALDH1A1HPGDMEN1KMT2A

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
CN-119285594-A 7-Aminobenzopyrone or 7-aminoquinolinone compound and application thereof 浙江大学金华研究院 2025-01-10 CN disclosed