SCHEMBL27942972

SCHEMBL27942972

COc1cccc(CCc2cc(=O)c3cc(OC)c(OC)cc3o2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.65
▸ HTR2C P28335 1/20 0.56
▸ HTR2B P41595 1/20 0.56
▸ PDE5A O76074 1/20 0.49
▸ CNR2 P34972 4/20 0.48
▸ GPR55 Q9Y2T6 3/20 0.48
▸ CNR1 P21554 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ ACHE P22303 2/20 0.47
▸ DAO P14920 1/20 0.46
▸ STS P08842 1/20 0.46
▸ CYP11B1 P15538 1/20 0.46
▸ CHRM2 P08172 1/20 0.45
▸ CHRM1 P11229 1/20 0.45

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
SCHEMBL27883084 0.88 PPARG (0.83) PPARGHTR2CHTR2BKDM4EALDH1A1
SCHEMBL30672825 0.88 PPARG (0.83) PPARGHTR2CHTR2BKDM4EALDH1A1
SCHEMBL30171371 0.87 PPARG (0.70) PPARGHTR2BPDE5AKDM4EALDH1A1
SCHEMBL27883078 0.87 PPARG (0.70) PPARGHTR2BPDE5AKDM4EALDH1A1
SCHEMBL28058709 0.86 PPARG (0.65) PPARGHTR2CHTR2BPDE5AKDM4E
SCHEMBL30672710 0.86 PPARG (0.65) PPARGHTR2CHTR2BPDE5AKDM4E
SCHEMBL30800378 0.85 PPARG (0.71) PPARGHTR2CHTR2BGPR55CNR1
SCHEMBL29128897 0.85 PPARG (0.71) PPARGHTR2CHTR2BGPR55CNR1
SCHEMBL30335871 0.79 PPARG (1.00) PPARGHTR2BPDE5AKDM4EALDH1A1
SCHEMBL29129669 0.79 KDM4E (0.54) PPARGPDE5ACNR2GPR55CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103630658-A Method for identifying natural agilawood and artificial agilawood GUANGDONG INST MICROBIOLOGY 2014-03-12 — — CN claimed
CN-103630658-A Method for identifying natural agilawood and artificial agilawood GUANGDONG INST MICROBIOLOGY 2014-03-12 — — CN disclosed
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