SCHEMBL29090933

SCHEMBL29090933

COc1ccc(C=CC(C)=O)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP1B1 Q16678 1/20 0.58
CA12 O43570 4/20 0.55
CA9 Q16790 4/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
MAPT P10636 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAOB P27338 1/20 0.51
JUN P05412 1/20 0.50
NFKB1 P19838 1/20 0.50
TNFRSF1A P19438 1/20 0.49
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LY96 Q9Y6Y9 1/20 0.47

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
SCHEMBL1920580 0.87 MIF (0.61) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL15239140 0.87 MIF (0.61) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL29090904 0.87 JUN (0.54) MAPTALDH1A1MEN1KMT2AMAOB
SCHEMBL30380928 0.87 MIF (0.61) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL1920579 0.87 MIF (0.61) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL14272842 0.86 CA12 (0.57) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL30560945 0.86 CA12 (0.57) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL19972316 0.86 CA12 (0.57) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL22398305 0.86 CA12 (0.57) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL30632936 0.86 CA12 (0.57) CYP1A1CYP1A2CYP1B1CA12CA9

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-116745467-A Composition for tin or tin alloy electroplating comprising a leveling agent 巴斯夫欧洲公司 2023-09-12 CN disclosed