SCHEMBL16212552

SCHEMBL16212552

CCCCCc1cc(O)c(CC=C(C)C)c(O)c1CC=C(C)C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.68
▸ SLC6A3 Q01959 2/20 0.58
▸ TRPM7 Q96QT4 1/20 0.58
▸ DAGLA Q9Y4D2 1/20 0.58
▸ PPARG P37231 2/20 0.52
▸ CNR1 P21554 2/20 0.52
▸ CNR2 P34972 2/20 0.52
▸ TRPV1 Q8NER1 2/20 0.52
▸ OPRM1 P35372 2/20 0.52
▸ TRPA1 O75762 1/20 0.52
▸ INHA P05111 1/20 0.52
▸ SLC6A2 P23975 1/20 0.52
▸ HTR2A P28223 1/20 0.52
▸ SLC6A4 P31645 1/20 0.52
▸ KCNH2 Q12809 1/20 0.52
▸ TRPM8 Q7Z2W7 1/20 0.52
▸ TRPV3 Q8NET8 1/20 0.52
▸ TRPV4 Q9HBA0 1/20 0.52
▸ TRPV2 Q9Y5S1 1/20 0.52
▸ PPARD Q03181 1/20 0.52

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
SCHEMBL21864135 0.88 SLC6A3 (0.76) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL16212640 0.85 CYP19A1 (0.53) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL16212952 0.85 CYP19A1 (0.53) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL9260013 0.82 CYP19A1 (0.59) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL27329793 0.82 CYP19A1 (0.56) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL24596011 0.80 SLC6A3 (0.76) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL9029687 0.80 CNR1 (0.76) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL31545838 0.79 TYR (0.51) CYP19A1TRPV1
SCHEMBL11759762 0.79 CYP19A1 (0.67) CYP19A1SLC6A3TRPM7DAGLAPPARG
SCHEMBL15361658 0.78 CYP19A1 (0.59) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014177593-A1 AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-11-06 — — WO claimed
US-20250090554-A1 A METHOD OF TREATING DEPRESSION BY IMMUNE MODULATION MYND LIFE SCIENCES INC (CA) 2025-03-20 — — US disclosed
WO-2014177593-A1 AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-11-06 — — WO disclosed
WO-2014177593-A1 AMORFRUTIN ANALOGS AS PPARGAMMA-MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-11-06 — — WO disclosed
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