SCHEMBL10928081

SCHEMBL10928081

COc1cccc(C(O)C2=CCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 3/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ IDO1 P14902 1/20 0.44
▸ TDO2 P48775 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ KDM4A O75164 1/20 0.43
▸ KDM4C Q9H3R0 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ FGFR2 P21802 1/20 0.40
▸ FGFR4 P22455 1/20 0.40
▸ FGFR3 P22607 1/20 0.40

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
SCHEMBL2093768 0.82 AOC3 (0.59) AOC3L3MBTL1ALDH1A1PKMCHRM2
SCHEMBL10675940 0.80 MTNR1A (0.45) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL27686957 0.78 AOC3 (0.54) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL477338 0.78 AOC3 (0.54) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL4822561 0.78 AOC3 (0.54) AOC3L3MBTL1PKMKDM4AKDM4C
SCHEMBL18529828 0.77 AOC3 (0.50) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL31476413 0.77 AOC3 (0.50) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL2352987 0.75 AOC3 (0.49) AOC3L3MBTL1IDO1TDO2PKM
SCHEMBL11604883 0.75 AOC3 (0.62) AOC3L3MBTL1ALDH1A1CHRM2CHRM1
SCHEMBL2087869 0.75 AOC3 (0.59) AOC3L3MBTL1ALDH1A1CHRM2CHRM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58154593-A — — None — — JP disclosed
EP-0132566-A2 Substituted benzophenones CIBA-GEIGY AG (CH) 1985-02-13 — — EP disclosed
JP-S58154593-A (E)-2-(2-METHYLENECYCLOHEXYLIDENE)ETHYL-(DIPHENYL)- PHOSPHINE OXIDE DAI ICHI SEIYAKU CO LTD 1983-09-14 — — JP disclosed
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