SCHEMBL28202407

SCHEMBL28202407

Fc1ccc(-c2ccco2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 5/20 0.56
PIK3CA P42336 5/20 0.56
HSD17B10 Q99714 3/20 0.43
GAA P10253 2/20 0.43
CASP6 P55212 1/20 0.42
USP2 O75604 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
PSMD14 O00487 1/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGS1 P23219 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL12700773 0.82 CASP6 (0.53) PIK3R1PIK3CAHSD17B10GAACASP6
SCHEMBL3251579 0.81 PIK3R1 (0.48) PIK3R1PIK3CAHSD17B10GAACASP6
SCHEMBL28267735 0.79 POLB (0.41) PIK3R1PIK3CAHSD17B10GAAUSP2
SCHEMBL13930938 0.79 RAB9A (0.58) PIK3R1PIK3CAHSD17B10GAAUSP2
SCHEMBL4990889 0.78 PIK3R1 (0.51) PIK3R1PIK3CAHSD17B10GAAUSP2
SCHEMBL23567450 0.77 PIK3R1 (0.53) PIK3R1PIK3CAHSD17B10USP2MEN1
SCHEMBL29550378 0.77 PIK3R1 (0.53) PIK3R1PIK3CAHSD17B10USP2MEN1
SCHEMBL30608864 0.77 TAAR1 (0.54) PIK3R1PIK3CAKDM4EALDH1A1ADORA2A
SCHEMBL21783928 0.77 KDM4E (0.51) HSD17B10GAAUSP2MEN1KMT2A
SCHEMBL26673561 0.77 TAAR1 (0.54) PIK3R1PIK3CAKDM4EALDH1A1ADORA2A

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-107674070-A A kind of cyano group imines thiazolidine furoyl amine compound and its preparation method and application 华南农业大学 2018-02-09 CN disclosed