SCHEMBL27800697

SCHEMBL27800697

CC1(NCc2ccccc2)CCCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SSTR3 P32745 1/20 0.42
IDO1 P14902 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
THRB P10828 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 1/20 0.40
OPRL1 P41146 2/20 0.39
APEX1 P27695 1/20 0.39
OPRM1 P35372 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
SCHEMBL27893441 0.98 KDM4E (0.42) CYP3A4MAPTKDM4ESSTR3IDO1
SCHEMBL11039283 0.96 CYP3A4 (0.43) CYP3A4MAPTKDM4ESSTR3IDO1
Bromide SCHEMBL11037477 0.94 CYP3A4 (0.42) CYP3A4MAPTKDM4ESSTR3IDO1
SCHEMBL27890446 0.92 CYP3A4 (0.46) CYP3A4MAPTKDM4EIDO1MEN1
SCHEMBL4604214 0.83 TACR1 (0.44) CYP3A4MAPTKDM4ESSTR3IDO1
SCHEMBL22857018 0.82 MC4R (0.44) CYP3A4MAPTKDM4EOPRM1
SCHEMBL7500962 0.81 CYP3A4 (0.43) CYP3A4MAPTKDM4ESSTR3TSHR
SCHEMBL27820512 0.81 ATM (0.48) CYP3A4MAPTSSTR3IDO1MEN1
SCHEMBL2661298 0.79 TAAR1 (0.47) CYP3A4MAPTSSTR3IDO1TSHR
SCHEMBL4191813 0.79 CYP3A4 (0.54) CYP3A4MEN1KMT2ATSHROPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104093758-B Shelf life of halogenated olefin-containing polyol blends improved by encapsulation of active ingredients 阿科玛股份有限公司 2017-04-26 CN claimed
CN-106397708-A Improved shelf life of polyol blends containing halogenated olefins by encapsulation of active components 阿科玛股份有限公司 2017-02-15 CN claimed
CN-104093758-A Shelf life of halogenated olefin-containing polyol blends improved by encapsulation of active ingredients ARKEMA INC 2014-10-08 CN claimed
CN-101896525-B Stabilization of polyurethane foam polyol premixes containing halogenated olefin blowing agents HONEYWELL INT INC 2014-06-18 CN claimed
CN-101896525-A Stabilization of polyurethane foam polyol premixes containing halogenated olefin blowing agents HONEYWELL INT INC 2010-11-24 CN claimed
CN-110234672-A PU formulation comprising HFO 巴斯夫欧洲公司 2019-09-13 CN disclosed
CN-109476979-A Polyol premixes with improved shelf life 阿科玛股份有限公司 2019-03-15 CN disclosed
CN-106046411-B The improved stability of polyurethane polyol blend comprising halogenated olefin blowing agents 阿科玛股份有限公司 2019-02-26 CN disclosed
CN-107949614-A Adhesion agent composition and its manufacture method and adhesive film 三井化学东赛璐株式会社 2018-04-20 CN disclosed
CN-104685021-B The improved stability of polyurethane polyol blend comprising halogenated olefin blowing agents 阿科玛股份有限公司 2018-04-13 CN disclosed
CN-106750482-A The stability of the improvement of the polyurethane polyol blend comprising halogenated olefin blowing agents 阿科玛股份有限公司 2017-05-31 CN disclosed
CN-106750490-A For the tetrafluoro butylene foaming agent of polyurethane foam 阿科玛股份有限公司 2017-05-31 CN disclosed
CN-103415548-A Improved Stability of Polyurethane Polyol Blends Containing Halogenated Olefin Blowing Agents ARKEMA INC 2013-11-27 CN disclosed
CN-103415543-A Improved Stability of Polyurethane Polyol Blends Containing Halogenated Olefin Blowing Agents ARKEMA INC 2013-11-27 CN disclosed
CN-102858829-A Method for Improving the Stability of Polyurethane Polyol Blends Containing Halogenated Olefin Blowing Agents ARKEMA INC 2013-01-02 CN disclosed
CN-102575046-A Tetrafluorobutene blowing agent compositions for polyurethane foams ARKEMA INC 2012-07-11 CN disclosed
CN-102498237-A Improved polyurethane foaming processes and foam properties using halogenated olefin blowing agent ARKEMA INC 2012-06-13 CN disclosed
CN-102159634-A Hfo-1234ze mixed isomers with hfc-245fa as a blowing agent, aerosol, and solvent HONEYWELL INT INC 2011-08-17 CN disclosed
CN-101952336-A Amine catalysts for polyurethane foams HONEYWELL INT INC 2011-01-19 CN disclosed
CN-101896525-A Stabilization of polyurethane foam polyol premixes containing halogenated olefin blowing agents HONEYWELL INT INC 2010-11-24 CN disclosed