SCHEMBL11490595

SCHEMBL11490595

CCCCCCCCCCC/C=C\C=C\C=C/C=C/C(=O)Oc1c(C)cc(C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.43
▸ FASN P49327 1/20 0.42
▸ CNR1 P21554 3/20 0.41
▸ CNR2 P34972 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ OXER1 Q8TDS5 2/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ FAAH O00519 2/20 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
SCHEMBL11329258 1.00 KDM4E (0.43) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL11320572 1.00 KDM4E (0.43) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL11325175 0.82 CNR1 (0.45) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL11491821 0.82 CNR1 (0.45) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL11491365 0.77 ZDHHC2 (0.56) KDM4EFASNCNR1CNR2FAAH
SCHEMBL11483550 0.77 ZDHHC2 (0.56) KDM4EFASNCNR1CNR2FAAH
SCHEMBL11483113 0.77 ZDHHC2 (0.56) KDM4EFASNCNR1CNR2FAAH
SCHEMBL23921985 0.76 FASN (0.53) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL118129 0.76 FASN (0.53) KDM4EFASNCNR1CNR2ALDH1A1
SCHEMBL18297784 0.76 FASN (0.53) KDM4EFASNCNR1CNR2ALDH1A1

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
US-4181670-A Phenyl 5Z,8Z,11Z,14Z-eicosatetraenoate and congeners G. D. SEARLE & CO. (US) 1980-01-01 — — US disclosed
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