SCHEMBL6686368

SCHEMBL6686368

CCCCCC(I)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.44
HTR2A P28223 3/20 0.42
CSNK1E P49674 1/20 0.41
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
OPRL1 P41146 2/20 0.41
NAAA Q02083 2/20 0.40
POLB P06746 2/20 0.40
CNR2 P34972 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HRH1 P35367 2/20 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
SCHEMBL28560209 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL6683678 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL6680534 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL11545835 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL282600 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL5214468 0.98 HTR2A (0.45) SIGMAR1HTR2ACSNK1EOPRM1OPRD1
SCHEMBL5034682 0.94 POLB (0.45) SIGMAR1HTR2AOPRM1OPRD1OPRK1
SCHEMBL3477567 0.85 AOC3 (0.46) SIGMAR1HTR2ALMNAHRH1
SCHEMBL15144138 0.84 HRH1 (0.44) SIGMAR1HTR2ALMNAHRH1
SCHEMBL81907 0.80 SIGMAR1 (0.64) SIGMAR1HTR2AOPRM1LMNAHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4801758-A OXIDATION, DIISOPROPYLBENZENE, ALKYLBENZENES, DECOMPOSITION OF DIHYDROPEROXIDE, ACID CATALYST NESTE OY (FI) 1989-01-31 US claimed
EP-4056742-B1 FIBERS, FIBER MULTILAYER STRUCTURE, SPINNING SOLUTION FOR ELECTROSPINNING, AND METHOD FOR PRODUCING FIBERS SHINETSU CHEMICAL CO (JP) 2026-04-15 EP disclosed
EP-3441508-B1 SILICONE-MODIFIED POLYURETHANE FIBER AND METHOD FOR MANUFACTURING SAME SHINETSU CHEMICAL CO (JP) 2025-06-04 EP disclosed
EP-3279373-B1 SILICONE-MODIFIED POLYURETHANE-BASED FIBER AND METHOD FOR MANUFACTURING SAME SHINETSU CHEMICAL CO (JP) 2024-03-06 EP disclosed
US-20220403097-A1 FIBERS, FIBER MULTILAYER STRUCTURE, SPINNING SOLUTION FOR ELECTROSPINNING, AND METHOD FOR PRODUCING FIBERS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-12-22 US disclosed
EP-4056742-A1 FIBERS, FIBER MULTILAYER STRUCTURE, SPINNING SOLUTION FOR ELECTROSPINNING, AND METHOD FOR PRODUCING FIBERS Shin-Etsu Chemical Co., Ltd. (JP) 2022-09-14 EP disclosed
US-20220169779-A1 MATERIAL FOR MEDICAL USE AND METHOD FOR PRODUCING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-06-02 US disclosed
US-11174335-B2 Silicone-modified polyurethane fiber and method for manufacturing same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-11-16 US disclosed
CN-107407011-B Organosilicon-modified polyurethane fiber and process for producing the same 信越化学工业株式会社 2021-10-08 CN disclosed
US-10421840-B2 Silicone-modified polyimide resin composition of solvent free type SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-09-24 US disclosed
US-20160039848-A1 SYMMETRIC HYPERBRANCHED TYPE SILICONE-MODIFIED POLYMERIZABLE COMPOUND, AND ITS MODULARIZED PREPARATION METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-02-11 US disclosed
EP-2975044-A1 SYMMETRICAL HYPERBRANCHED SILICONE-MODIFIED POLYMERIZABLE COMPOUND AND PREPARATION METHOD MODULARIZING SAME Shin-Etsu Chemical Co., Ltd. (JP) 2016-01-20 EP disclosed
US-9233991-B2 Symmetric hyperbranched silicone-modified polymerizable compound and modularized manufacturing method thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-01-12 US disclosed
CN-102557896-B (Poly) fluorine substituted phenyl diacetylene (bi) phenyl derivative, and preparation method and application thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD 2015-03-11 CN disclosed
US-20140275599-A1 SYMMETRIC HYPERBRANCHED SILICONE-MODIFIED POLYMERIZABLE COMPOUND AND MODULARIZED MANUFACTURING METHOD THEREOF SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-18 US disclosed
EP-2778169-A1 Symmetric hyperbranched silicone-modified polymerizable compound and modularized manufacturing method thereof Shin-Etsu Chemical Co., Ltd. (JP) 2014-09-17 EP disclosed
EP-0985649-B1 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES (JP) 2004-11-24 EP disclosed
US-6462248-B1 THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS TORAY INDUSTRIES, INC. (JP) 2002-10-08 US disclosed
EP-0985649-A2 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES, INC. (JP) 2000-03-15 EP disclosed
WO-1997010247-A1 CLAVULANIC ACID DERIVATIVES FOR TREATING ATHEROSCLEROSIS SMITHKLINE BEECHAM P.L.C. (GB) 1997-03-20 WO disclosed