SCHEMBL1507285

SCHEMBL1507285

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.ClC(Cl)c1ccccc1.[Ru]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
IDO1 P14902 2/20 0.40
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
OPRM1 P35372 3/20 0.36
OPRL1 P41146 3/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
LMNA P02545 1/20 0.34
BCHE P06276 3/20 0.34
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
KCNA5 P22460 2/20 0.33
CYP2C19 P33261 2/20 0.33
KCNH2 Q12809 2/20 0.33
EPHX1 P07099 2/20 0.33
CYP19A1 P11511 1/20 0.33
KCNE1 P15382 1/20 0.33

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
SCHEMBL1517475 1.00 TSHR (0.52) TSHRIDO1GAAL3MBTL1OPRM1
SCHEMBL27514711 0.98 TSHR (0.54) TSHRIDO1GAAL3MBTL1OPRM1
SCHEMBL5185625 0.98 TSHR (0.54) TSHRIDO1GAAL3MBTL1OPRM1
SCHEMBL27637956 0.81 IDO1 (0.40) IDO1GAAL3MBTL1OPRM1OPRL1
Chlorobenzene SCHEMBL27446491 0.76 TSHR (0.48) TSHRGAALMNACYP1A2CYP3A4
SCHEMBL28544200 0.76 IDO1 (0.36) IDO1GAAL3MBTL1OPRM1OPRL1
Biphenyl SCHEMBL28193720 0.76 ALDH1A1 (0.43) L3MBTL1LMNAKDM4E
Toluene SCHEMBL28188524 0.75 TSHR (0.46) TSHRGAAL3MBTL1LMNACYP1A2
SCHEMBL27705800 0.74 TSHR (0.93) TSHRIDO1LMNACYP2D6
Benzene SCHEMBL9464137 0.74 KDM4E (0.30) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106554341-A A kind of preparation method and purposes of mangostin and the like 南京美竹医药科技有限公司 2017-04-05 CN claimed
CN-106164773-B Radiation sensitive resin composition, resin film and electronic component ZEON CORP. (JP) 2019-11-01 CN disclosed
CN-110366704-A Radiation sensitive resin composition and electronic component 日本瑞翁株式会社 2019-10-22 CN disclosed
CN-110312749-A CYCLOPENTENE RING-OPENING COPOLYMER AND METHOD FOR PRODUCING SAME 日本瑞翁株式会社 2019-10-08 CN disclosed
CN-107474048-B A kind of synthetic method of amido imide dibenzo suberol 河南工程学院 2019-07-19 CN disclosed
CN-109844008-A Rubber composition and rubber cross object 日本瑞翁株式会社 2019-06-04 CN disclosed
CN-109417115-A Infraluminescence LED 日本瑞翁株式会社 2019-03-01 CN disclosed
CN-106459383-B Cyclopentene ring-opening polymerization polymer and its manufacturing method, polymer composition and crosslinked polymer object 日本瑞翁株式会社 2018-12-07 CN disclosed
CN-108885398-A Radiation sensitive resin composition and electronic component 日本瑞翁株式会社 2018-11-23 CN disclosed
CN-108779317-A Resin composition, resin film, and electronic component 日本瑞翁株式会社 2018-11-09 CN disclosed
US-20080214741-A1 Reacting nitrile rubber in presence of hydrogen, co-olefin, and catalyst; low/narrow molecular weight distribution LANXESS INC. (CA) 2008-09-04 US disclosed
EP-1426383-B1 Process for the preparation of low molecular weight hydrogenated nitrile rubber LANXESS INC (CA) 2008-02-27 EP disclosed
CN-1735441-A Combination for treating attention deficit hyperactivity disorder PHARMACIA & UPJOHN CO LLC (US) 2006-02-15 CN disclosed
EP-1621577-A2 Polymer composite comprising a low molecular weight nitrile rubber Lanxess Inc. (CA) 2006-02-01 EP disclosed
CN-1717629-A Radiation-sensitive resin composition ZEON CORP (JP) 2006-01-04 CN disclosed
EP-1426384-A1 Process for the preparation of low molecular weight hydrogenated nitrile rubber Bayer Inc. (CA) 2004-06-09 EP disclosed
EP-1426383-A1 Process for the preparation of low molecular weight hydrogenated nitrile rubber Bayer Inc. (CA) 2004-06-09 EP disclosed
CN-1431904-A Protease inhitors SMITHKLINE BEECHAM CO (US) 2003-07-23 CN disclosed
CN-1416346-A Peotease inhibitors SMITHKLINE BEECHAM CORP (US) 2003-05-07 CN disclosed
CN-1216618-A Photoresist compositions comprising polycyclic polymers with acid labile pendant groups GOODRICH CO B F (US) 1999-05-12 CN disclosed