SCHEMBL9750819

SCHEMBL9750819

CCCCCC(C)COCC(C)CCCCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
ACE2 Q9BYF1 1/20 0.43
CA1 P00915 2/20 0.38
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.37
DNM1 Q05193 2/20 0.36
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
FDPS P14324 1/20 0.34
SMPD1 P17405 2/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL9750779 0.97 ACE2 (0.47) OPRM1ACE2SPHK1LMNADNM1
SCHEMBL28614253 0.97 ACE2 (0.47) OPRM1ACE2SPHK1LMNADNM1
SCHEMBL27658942 0.97 ACE2 (0.47) OPRM1ACE2SPHK1LMNADNM1
SCHEMBL28945783 0.97 ACE2 (0.47) OPRM1ACE2SPHK1LMNADNM1
SCHEMBL28945775 0.97 ACE2 (0.47) OPRM1ACE2SPHK1LMNADNM1
SCHEMBL14646875 0.93 OPRM1 (0.41) OPRM1ACE2CA1SPHK1LMNA
SCHEMBL786298 0.92 CYP3A4 (0.38) OPRM1ACE2CA1LMNADNM1
SCHEMBL14671203 0.90 OPRM1 (0.48) OPRM1ACE2CA1SPHK1LMNA
SCHEMBL3392448 0.89 USP2 (0.46) OPRM1ACE2SPHK1USP2
SCHEMBL3314759 0.88 OPRM1 (0.46) OPRM1ACE2SPHK1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US claimed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US claimed
CN-103847234-B Ink-jet recording apparatus SEIKO EPSON CORP. (JP) 2016-05-04 CN disclosed
CN-103847234-A Ink jet recording apparatus SEIKO EPSON CORP 2014-06-11 CN disclosed
CN-102043339-A Positive radiation-sensitive resin composition, and interlayer insulating film and method for forming the same JSR CORP 2011-05-04 CN disclosed
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0156512-B1 PROCESS FOR PREPARING CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1989-06-14 EP disclosed
US-4804653-A INSECTICIDES, MITICIDES UNIROYAL CHEMICAL COMPANY, INC. (US) 1989-02-14 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP disclosed
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US disclosed
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US disclosed
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US disclosed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US disclosed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US disclosed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US disclosed