SCHEMBL8949575

SCHEMBL8949575

CCCCCCC(C)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.46
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 6/20 0.42
PLA2G2C Q5R387 1/20 0.42
NR1I2 O75469 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
GBA1 P04062 1/20 0.39
CYP2C9 P11712 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
TSHR P16473 2/20 0.38
MMP9 P14780 2/20 0.38
MMP13 P45452 2/20 0.38
ADAM17 P78536 2/20 0.38
MMP1 P03956 2/20 0.38
LMNA P02545 1/20 0.38
ALB P02768 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL3443920 1.00 MCHR1 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL8744438 1.00 MCHR1 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL9144466 1.00 MCHR1 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL28915902 1.00 MCHR1 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL9060708 0.98 CA12 (0.45) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL9227919 0.98 CA12 (0.45) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL9060692 0.98 CA12 (0.45) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL4209138 0.94 CA12 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL31370679 0.94 CA12 (0.46) MCHR1CA12CA2CA9ALDH1A1
SCHEMBL4209136 0.94 CA12 (0.46) MCHR1CA12CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116583509-A Compounds and methods for treating cancer 上海睿跃生物科技有限公司 2023-08-11 CN disclosed
WO-2017157888-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA-GEVAERT (BE) 2017-09-21 WO disclosed
EP-3099695-A1 COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2016-12-07 EP disclosed
US-9240614-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2016-01-19 US disclosed
WO-2015113452-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-08-06 WO disclosed
EP-2579377-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES (JP) 2014-09-03 EP disclosed
EP-2579377-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2013-04-10 EP disclosed
US-20130071733-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2013-03-21 US disclosed
US-5578677-A POLYCARBOXYLIC ACID ESTERIFIED WITH MONOVINYL ETHER, ADDITIONAL REACTIVE GROUPS, CLEAR COATS FOR AUTOMOBILES NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1996-11-26 US disclosed
EP-0451738-B1 Thermosetting compositions, thermal latent carboxyl compounds and methods of preparation thereof NIPPON OILS & FATS CO LTD (JP) 1996-11-20 EP disclosed
US-4737313-A OPITICALLY ACTIVE CHISSO CORPORATION (JP) 1988-04-12 US disclosed
US-4729847-A LIGHT SWITCHING ELEMENT CHISSO CORPORATION (JP) 1988-03-08 US disclosed
EP-0255236-A2 Fluorine-containing chiral smectic liquid crystals MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-02-03 EP disclosed
US-4689176-A AROMATIC ESTER COMPOUND CHISSO CORPORATION (JP) 1987-08-25 US disclosed
US-4668427-A LIGHT SWITCHING ELEMENT CHISSO CORPORATION (JP) 1987-05-26 US disclosed
EP-0212838-A1 Optically active liquid crystal compound having methyleneoxy group and composition containing same Chisso Corporation (JP) 1987-03-04 EP disclosed
EP-0197677-A2 Halogen-containing, optically active liquid crystal compound and liquid crystal composition containing same Chisso Corporation (JP) 1986-10-15 EP disclosed
WO-1986004893-A1 PROCESS FOR THE PREPARATION OF ALKYL FLUORIDES ZAMBON S.P.A. (IT) 1986-08-28 WO disclosed
EP-0174191-A1 Liquid crystal compound having methyleneoxy group and composition containing same Chisso Corporation (JP) 1986-03-12 EP disclosed
EP-0164814-A2 Liquid crystalline ester compounds and mixtures thereof Chisso Corporation (JP) 1985-12-18 EP disclosed