SCHEMBL10727255

SCHEMBL10727255

CCCCCC(=O)OCCC(C)CCCC(C)(C)c1ccc(O)cc1O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 11/20 0.44
▸ CNR1 P21554 7/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ DGKA P23743 1/20 0.39
▸ EGFR P00533 1/20 0.38
▸ ELANE P08246 1/20 0.37

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
SCHEMBL10571806 0.90 CNR2 (0.45) CNR2CNR1DGKAELANE
SCHEMBL10578212 0.89 CNR2 (0.47) CNR2CNR1DGKAELANE
SCHEMBL10731195 0.89 EGFR (0.40) CNR2KDM4EHTTEGFR
SCHEMBL10726905 0.85 CNR2 (0.48) CNR2CNR1HTTDGKA
SCHEMBL10733562 0.85 CNR2 (0.48) CNR2CNR1HTTDGKA
SCHEMBL10732226 0.84 EGFR (0.41) EGFR
SCHEMBL10410622 0.84 CNR2 (0.51) CNR2CNR1DGKA
SCHEMBL10852708 0.83 CNR2 (0.41) CNR2CNR1DGKA
SCHEMBL10575884 0.83 CNR2 (0.38) CNR2CNR1DGKAEGFR
SCHEMBL10846297 0.82 CNR2 (0.42) CNR2CNR1DGKA

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
US-4661601-A PHOTOGRAPHIC BLACK COLOR COUPLER CIBA-GEIGY AG (CH) 1987-04-28 — — US disclosed
EP-0069066-A1 Resorcinols and their preparation CIBA-GEIGY AG (CH) 1983-01-05 — — EP disclosed
Send feedback