SCHEMBL28290001

SCHEMBL28290001

CCCCCC=CCC=CCCCCCCCCCCCCCCC(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.55
TRPV1 Q8NER1 1/20 0.53
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 3/20 0.52
F7 P08709 3/20 0.52
F3 P13726 3/20 0.52
PPARG P37231 2/20 0.52
PPARD Q03181 2/20 0.52
PPARA Q07869 2/20 0.52
DUSP3 P51452 1/20 0.52
PTPN7 P35236 1/20 0.52
FFAR1 O14842 1/20 0.52
LMNA P02545 1/20 0.52
FABP3 P05413 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP19A1 P11511 1/20 0.52
FABP4 P15090 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
TSHR P16473 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
SCHEMBL28289999 1.00 CNR1 (0.55) CNR1TRPV1ALDH1A1KDM4EF7
SCHEMBL31259026 1.00 CNR1 (0.55) CNR1TRPV1ALDH1A1KDM4EF7
SCHEMBL23490678 1.00 CNR1 (0.55) CNR1TRPV1ALDH1A1KDM4EF7
SCHEMBL9211322 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL9208857 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL9545662 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL9545636 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL2021239 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL22863166 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG
SCHEMBL9545708 0.94 FAAH (0.54) CNR1TRPV1F7F3PPARG

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-109640962-A POLYNUCLEOTIDES ENCODING RELAXIN 摩登纳特斯有限公司 2019-04-16 CN disclosed