SCHEMBL10885299

SCHEMBL10885299

CCCCC/C=C/C/C=C/CCCCCCCCCC(=O)NCc1ccc(O)c(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.96
HPGD P15428 3/20 0.96
MAPT P10636 2/20 0.96
CYP1A2 P05177 2/20 0.96
CYP3A4 P08684 2/20 0.96
CYP2D6 P10635 2/20 0.96
MEN1 O00255 1/20 0.96
TP53 P04637 1/20 0.96
MTOR P42345 1/20 0.96
KMT2A Q03164 1/20 0.96
ALDH1A1 P00352 2/20 0.94
EPHX2 P34913 1/20 0.84
CYP2C9 P11712 1/20 0.83
ALOX15 P16050 1/20 0.83
CYP2C19 P33261 1/20 0.83
BLM P54132 1/20 0.83
PMP22 Q01453 1/20 0.83

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
SCHEMBL5889456 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10883574 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10884118 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10547186 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10546382 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10886835 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10886839 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10883567 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10547191 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4
SCHEMBL10546388 1.00 TRPV1 (0.96) TRPV1HPGDMAPTCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0132346-B1 NOVEL COMPOUNDS AND COMPOSITIONS USEFUL FOR PRODUCING ANALGESIA THE PROCTER & GAMBLE COMPANY (US) 1986-09-24 EP claimed
US-4544669-A ALKADIENAMIDES THE PROCTER & GAMBLE COMPANY (US) 1985-10-01 US claimed
EP-0132346-A1 Novel compounds and compositions useful for producing analgesia THE PROCTER & GAMBLE COMPANY (US) 1985-01-30 EP claimed
EP-0132346-B1 NOVEL COMPOUNDS AND COMPOSITIONS USEFUL FOR PRODUCING ANALGESIA THE PROCTER & GAMBLE COMPANY (US) 1986-09-24 EP disclosed
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