SCHEMBL3962037

SCHEMBL3962037

CCNc1ccc(C)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
CYP1A2 P05177 3/20 0.53
CYP2D6 P10635 3/20 0.53
CYP2C9 P11712 3/20 0.53
CYP2C19 P33261 3/20 0.53
CYP3A4 P08684 3/20 0.53
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
TSHR P16473 2/20 0.50
RECQL P46063 1/20 0.50
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50
TUBB4B P68371 1/20 0.50
TUBB3 Q13509 1/20 0.50
TUBB2A Q13885 1/20 0.50
TUBB8 Q3ZCM7 1/20 0.50

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
Methanesulfonamide SCHEMBL11539854 0.89 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11990845 0.84 ALDH1A1 (0.56) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL6572164 0.83 ESR1 (0.48) ALDH1A1CYP3A4TSHRRECQLMAPT
SCHEMBL29642426 0.83 ARG1 (0.59) CYP1A2CYP3A4GAATSHRRECQL
SCHEMBL347616 0.83 ARG1 (0.59) CYP1A2CYP3A4GAATSHRRECQL
Hydrochloric Acid SCHEMBL1825913 0.81 ARG1 (0.57) ALDH1A1GAATUBB4ATUBBTUBA3C
SCHEMBL30536438 0.80 ALDH1A1 (0.55) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL1803111 0.80 ALDH1A1 (0.55) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL29428385 0.80 ALDH1A1 (0.56) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL95129 0.80 ALDH1A1 (0.56) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19

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 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107099559-A The method that biotechnology prepares the cinnamic acid methylated and cinnamate, the phenyl ethylamine methylated and its coupled product 西姆莱斯有限公司 2017-08-29 CN claimed
US-7070628-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-07-04 US claimed
US-7070627-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-07-04 US claimed
US-7056352-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-06-06 US claimed
EP-1374840-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP claimed
EP-1438948-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP claimed
EP-1380285-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP claimed
EP-1374841-B1 Composition for dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP claimed
EP-1378229-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-12 EP claimed
US-6852133-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2005-02-08 US claimed
EP-1374840-A2 Composition for the dyeing of human hair KPSS-Kao Professional Salon Services GmbH (DE) 2004-01-02 EP claimed
US-20030233716-A1 Composition for the dyeing of human hair KPSS - KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2003-12-25 US claimed
US-20030233715-A1 Composition for the dyeing of human hair KPSS - KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2003-12-25 US claimed
CN-1060036-C Composition forthe oxidation dyeingof keratinous fiberes comprising a para-phenylenediamine containinga primary, secondary or tertiary amine function, a meta-phenylenediamine and a para-aminopheno.... OREAL (FR) 2001-01-03 CN claimed
US-5993791-A Oxidation dye composition for keratinous fibres comprising a para-aminophenol, a meta-aminophenol and a 2-substituted para-aminophenol L'OREAL (FR) 1999-11-30 US claimed
EP-0634165-B1 Oxidative dying composition for keratinous fibers containing a para-aminophenol, a meta-aminophenol and a 2-substituted para-aminophenol OREAL (FR) 1997-09-24 EP claimed
EP-0667143-B1 Keratinous fiber oxidation dyeing composition containing a paraphenylenediamine, a metaphenylenediamine and a paraaminophenol or a metaaminophenol OREAL (FR) 1996-10-09 EP claimed
CN-1109737-A Composition forthe oxidation dyeingof keratinous fiberes comprising a para-phenylenediamine containinga primary, secondary or tertiary amine function, a meta-phenylenediamine and a para-aminopheno.... OREAL (FR) 1995-10-11 CN claimed
EP-0667143-A1 Keratinous fiber oxidation dyeing composition containing a paraphenylenediamine, a metaphenylenediamine and a paraaminophenol or a metaaminophenol L'OREAL (FR) 1995-08-16 EP claimed
EP-0634165-A1 Keratinous fibers oxidation dying composition containing a para-aminophenol, a meta-aminophenol and a 2-substituted para-aminophenol L'OREAL (FR) 1995-01-18 EP claimed