SCHEMBL1716142

SCHEMBL1716142

Cc1ccccc1CCC(C)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
TYR P14679 2/20 0.47
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
PTGER1 P34995 1/20 0.39
PTGFR P43088 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GPR84 Q9NQS5 1/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
DAO P14920 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL15255040 0.88 TAAR1 (0.48) TAAR1TYRALDH1A1GAATSHR
SCHEMBL9794663 0.87 TAAR1 (0.56) TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL3047458 0.83 TAAR1 (0.56) TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL1983016 0.82 TAAR1 (0.55) TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL16265337 0.80 TAAR1 (0.48) TAAR1ALDH1A1GAATSHRPTGER1
SCHEMBL10937017 0.80 TAAR1 (0.48) TAAR1ALDH1A1PTGER1PTGFRKMT2A
SCHEMBL15945059 0.79 SLC6A4 (0.63) TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL2486648 0.79 TYR (0.61) TAAR1TYRSLC6A4TSHR
SCHEMBL14286302 0.79 TYR (0.47) TYRSLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL3652083 0.79 TAAR1 (0.47) TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370767-B2 Process for preparing alcohols by electrochemical reductive coupling BASF SE (DE) 2019-08-06 US claimed
US-9040592-B2 Process for preparing 4-cyclohexyl-2-methyl-2-butanol BASF SE (DE) 2015-05-26 US claimed
EP-1716159-B1 BICYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS MOMENTIVE PERFORMANCE MAT INC (US) 2011-07-13 EP claimed
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 US claimed
US-9102665-B2 Cysteinyl leukotriene antagonists SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2015-08-11 US disclosed
EP-2834233-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS Orion Corporation (FI) 2015-02-11 EP disclosed
US-20140155596-A1 CYSTEINYL LEUKOTRIENE ANTAGONISTS SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2014-06-05 US disclosed
WO-2013150173-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS ORION CORPORATION (FI) 2013-10-10 WO disclosed
US-20020032132-A1 Cyclic compounds and their use as precursors of fragrant alcohols ANTARES CAPITAL CORPORATION, AS AGENT 2002-03-14 US disclosed
US-20020016269-A1 Particle perfume delivery system THE PROCTER & GAMBLE CO. 2002-02-07 US disclosed
US-6184188-B1 LAUNDRY DETERGENT COMPRISING SPECIFIED BETA-KETO ESTER ?PRO-FRAGRANCES? SUCH AS 3,7-DIMETHYL-1,6-OCTADIEN-3-YL 1-(2-NAPHTHYL)-3-OXO-PROPIONATE, AND A DETERSIVE SURFACTANT, AND CARRIERS THE PROCTER & GAMBLE COMPANY 2001-02-06 US disclosed
EP-0287084-A2 Alcohols containing 2-methyl or 2-methoxyphenyl groups, and their use as flavouring agents Consortium für elektrochemische Industrie GmbH (DE) 1988-10-19 EP disclosed
EP-0149976-A2 Substituted imidazoles CIBA-GEIGY AG (CH) 1985-07-31 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients F9, RPL39, ECPAS TAAR1 1368/4885TYR 2269/4885SLC6A2 4834/4885
US-20140155596-A1 CYSTEINYL LEUKOTRIENE ANTAGONISTS LTC4S, CYSLTR2, CYSLTR1 TAAR1 2187/4885TYR 2536/4885SLC6A2 3058/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.