SCHEMBL9808674

SCHEMBL9808674

CCCCCCCC/C=C/CCCCCCCCNC(=O)Cc1ccc(O)c(OC)c1

nearest known ligand 0.87

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 5/20 0.70
▸ MAPT P10636 2/20 0.70
▸ HPGD P15428 2/20 0.70
▸ MEN1 O00255 1/20 0.70
▸ TP53 P04637 1/20 0.70
▸ CYP1A2 P05177 1/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ CYP2D6 P10635 1/20 0.70
▸ MTOR P42345 1/20 0.70
▸ KMT2A Q03164 1/20 0.70
▸ ALDH1A1 P00352 1/20 0.66
▸ HTR1A P08908 2/20 0.61

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
SCHEMBL504257 1.00 TRPV1 (0.70) TRPV1MAPTHPGDMEN1TP53
SCHEMBL504255 1.00 TRPV1 (0.70) TRPV1MAPTHPGDMEN1TP53
SCHEMBL29380151 1.00 TRPV1 (0.70) TRPV1MAPTHPGDMEN1TP53
SCHEMBL1586047 0.98 TRPV1 (0.67) TRPV1MAPTHPGDMEN1TP53
SCHEMBL1585893 0.93 TRPV1 (0.61) TRPV1MAPTHPGDMEN1TP53
SCHEMBL29530847 0.93 TRPV1 (0.74) TRPV1HPGDCYP1A2CYP3A4CYP2D6
SCHEMBL28755565 0.93 TRPV1 (0.74) TRPV1HPGDCYP1A2CYP3A4CYP2D6
SCHEMBL9808706 0.93 TRPV1 (0.74) TRPV1HPGDCYP1A2CYP3A4CYP2D6
SCHEMBL258429 0.93 TRPV1 (0.74) TRPV1HPGDCYP1A2CYP3A4CYP2D6
SCHEMBL155980 0.87 TRPV1 (0.85) TRPV1MAPTHPGDMEN1TP53

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0206609-B1 COMPOUNDS AND COMPOSITIONS HAVING ANTI-INFLAMMATORY AND ANALGESIC ACTIVITY THE PROCTER & GAMBLE COMPANY (US) 1989-09-20 — — EP claimed
EP-0206609-A1 Compounds and compositions having anti-inflammatory and analgesic activity THE PROCTER & GAMBLE COMPANY (US) 1986-12-30 — — EP claimed
US-5013759-A Phenylacetic acid amide or thioamide derivatives THE PROCTER & GAMBLE COMPANY (US) 1991-05-07 — — US disclosed
EP-0206609-B1 COMPOUNDS AND COMPOSITIONS HAVING ANTI-INFLAMMATORY AND ANALGESIC ACTIVITY THE PROCTER & GAMBLE COMPANY (US) 1989-09-20 — — EP disclosed
EP-0206609-A1 Compounds and compositions having anti-inflammatory and analgesic activity THE PROCTER & GAMBLE COMPANY (US) 1986-12-30 — — EP disclosed
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