SCHEMBL11019361

SCHEMBL11019361

CCCCC/C=C/C/C=C/CCCCCCCC(=O)NCc1ccc(O)c(O)c1

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.81
▸ ALOX12 P18054 2/20 0.79
▸ MAPT P10636 4/20 0.75
▸ HPGD P15428 4/20 0.75
▸ TP53 P04637 2/20 0.75
▸ CYP1A2 P05177 2/20 0.75
▸ CYP3A4 P08684 2/20 0.75
▸ MTOR P42345 2/20 0.75
▸ KDM4E B2RXH2 1/20 0.75
▸ NPC1 O15118 1/20 0.75
▸ GMNN O75496 1/20 0.75
▸ USP2 O75604 1/20 0.75
▸ LMNA P02545 1/20 0.75
▸ POLB P06746 1/20 0.75
▸ CYP2C9 P11712 1/20 0.75
▸ IDE P14735 1/20 0.75
▸ ALOX15 P16050 1/20 0.75
▸ NFKB1 P19838 1/20 0.75
▸ MAPK1 P28482 1/20 0.75
▸ CYP2C19 P33261 1/20 0.75

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
SCHEMBL11019366 1.00 TRPV1 (0.81) TRPV1ALOX12MAPTHPGDTP53
SCHEMBL10713028 0.98 TRPV1 (0.85) TRPV1ALOX12MAPTHPGDTP53
SCHEMBL10068244 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL10068349 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL10068102 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL28719248 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL29550109 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL10068245 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL10038328 0.90 TRPV1 (1.00) TRPV1MAPTHPGDTP53CYP1A2
SCHEMBL3693269 0.88 ALOX12 (1.00) TRPV1ALOX12MAPTHPGDTP53

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-4544669-A ALKADIENAMIDES THE PROCTER & GAMBLE COMPANY (US) 1985-10-01 — — US disclosed
EP-0132346-A1 Novel compounds and compositions useful for producing analgesia THE PROCTER & GAMBLE COMPANY (US) 1985-01-30 — — EP disclosed
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