SCHEMBL11482185

SCHEMBL11482185

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.51
▸ CNR1 P21554 6/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ MAPT P10636 4/20 0.50
▸ CNR2 P34972 4/20 0.50
▸ FAAH O00519 4/20 0.50
▸ HPGD P15428 2/20 0.50
▸ THRB P10828 1/20 0.50
▸ PPARG P37231 2/20 0.49
▸ BLM P54132 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ HSPD1 P10809 1/20 0.49
▸ CYP19A1 P11511 1/20 0.49
▸ FABP4 P15090 1/20 0.49
▸ ALOX15 P16050 1/20 0.49

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
SCHEMBL11313260 0.91 ADORA3 (0.54) CNR1ALDH1A1MAPTHPGDPPARG
SCHEMBL27652865 0.86 KMT2A (0.55) ALDH1A1MAPTMEN1LMNAALOX15
SCHEMBL4809471 0.85 ALDH1A1 (0.57) MGLLCNR1ALDH1A1MAPTCNR2
SCHEMBL11491826 0.85 MGLL (0.55) MGLLCNR1ALDH1A1MAPTCNR2
SCHEMBL4809462 0.85 ALDH1A1 (0.57) MGLLCNR1ALDH1A1MAPTCNR2
SCHEMBL31094048 0.85 KMT2A (0.57) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL32684888 0.85 KMT2A (0.57) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL32685014 0.85 KMT2A (0.57) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL28588550 0.85 KMT2A (0.49) ALDH1A1MAPTKDM4EMEN1LMNA
SCHEMBL11491370 0.84 ALDH1A1 (0.58) MGLLCNR1ALDH1A1MAPTCNR2

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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