SCHEMBL38533242

SCHEMBL38533242

O=C(O)c1ccccc1C(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.66
SRD5A2 P31213 3/20 0.65
CDC25B P30305 2/20 0.62
ATM Q13315 1/20 0.62
NR4A1 P22736 1/20 0.61
CYP2C8 P10632 1/20 0.58
CDC25A P30304 1/20 0.58
HSD17B10 Q99714 1/20 0.58
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
EPHX2 P34913 1/20 0.51
NPC1 O15118 1/20 0.51
CRHBP P24387 1/20 0.51
RAB9A P51151 1/20 0.51
CRHR2 Q13324 1/20 0.51
ALOX15 P16050 1/20 0.50
LTC4S Q16873 1/20 0.50
CA1 P00915 1/20 0.50

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
SCHEMBL11751786 1.00 AKR1C3 (0.66) AKR1C3SRD5A2CDC25BATMNR4A1
SCHEMBL27524893 0.84 AKR1C3 (0.91) AKR1C3SRD5A2CDC25BATMNR4A1
SCHEMBL5310287 0.84 AKR1C3 (0.58) AKR1C3SRD5A2CDC25BATMNR4A1
SCHEMBL9537242 0.83 KDM4E (0.62) AKR1C3SRD5A2CDC25BCYP2C8CDC25A
SCHEMBL1781341 0.83 SRD5A2 (0.77) SRD5A2CYP2C8CES2CES1ALDH1A1
SCHEMBL29550462 0.82 TDP1 (0.66) AKR1C3SRD5A2CDC25BATMNR4A1
SCHEMBL11176158 0.82 TDP1 (0.66) AKR1C3SRD5A2CDC25BATMNR4A1
SCHEMBL8362275 0.82 SRD5A2 (0.55) SRD5A2CYP2C8CES2CES1ALDH1A1
SCHEMBL9229493 0.81 SRD5A2 (0.67) AKR1C3SRD5A2CDC25BCDC25AHSD17B10
SCHEMBL6094601 0.81 MAPT (0.65) SRD5A2CYP2C8HSD17B10CES2CES1

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-122059950-A Compounds with proteasome agonistic activity, preparation method and application thereof 浙大城市学院 2026-05-19 CN disclosed