SCHEMBL11484456

SCHEMBL11484456

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CC(C)CC(=O)Oc1ccc(C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 6/20 0.41
▸ CNR2 P34972 4/20 0.41
▸ FAAH O00519 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ MGLL Q99685 1/20 0.38

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
SCHEMBL11320589 0.87 L3MBTL1 (0.40) ALDH1A1MAPT
SCHEMBL11482185 0.83 MGLL (0.51) CNR1CNR2FAAHALDH1A1MAPT
SCHEMBL11483676 0.80 CNR1 (0.49) CNR1CNR2
SCHEMBL11483058 0.77 CNR1 (0.48) CNR1CNR2ALDH1A1MAPTHPGD
SCHEMBL11494863 0.77 ALOX5 (0.51) CNR1CNR2FAAHALDH1A1MAPT
SCHEMBL11483644 0.75 FAAH (0.41) CNR1CNR2FAAHALDH1A1MAPT
SCHEMBL11313260 0.75 ADORA3 (0.54) CNR1ALDH1A1MAPTHPGD
SCHEMBL27652865 0.72 KMT2A (0.55) ALDH1A1MAPT
SCHEMBL11491857 0.72 ALDH1A1 (0.60) CNR1FAAHALDH1A1MAPTHPGD
SCHEMBL2571212 0.72 ALDH1A1 (0.60) CNR1FAAHALDH1A1MAPTHPGD

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