SCHEMBL6583604

SCHEMBL6583604

CC(CCl)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.58
AOC3 Q16853 2/20 0.52
TRPA1 O75762 4/20 0.50
RIPK1 Q13546 1/20 0.50
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
LMNA P02545 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL2736711 1.00 TAAR1 (0.58) TAAR1AOC3TRPA1RIPK1TSHR
SCHEMBL30750937 0.97 TAAR1 (0.56) TAAR1AOC3TRPA1RIPK1TSHR
SCHEMBL28751353 0.89 TAAR1 (0.48) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL11758612 0.86 GRIA4 (0.50) TAAR1AOC3
SCHEMBL536253 0.86 ESR1 (0.41) TAAR1AOC3TRPA1RIPK1TSHR
Tromethamine SCHEMBL11022757 0.82 TAAR1 (0.47) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL5471184 0.82 HDAC4 (0.41) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL10598514 0.81 TRPA1 (0.64) TAAR1AOC3TRPA1RIPK1TSHR
SCHEMBL2243710 0.80 RIPK1 (0.57) TAAR1AOC3TRPA1RIPK1
SCHEMBL3672929 0.78 TRPA1 (0.67) TAAR1AOC3TRPA1RIPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116425930-A Poly (isomonoolefin) copolymer, initiator system and application 北京石油化工学院 2023-07-14 CN claimed
CN-109694454-B Preparation method of block copolymer and monovinylarene-isomonoolefin-monovinylarene block copolymer 中国石油化工股份有限公司 2021-09-21 CN claimed
CN-109694453-B Preparation method of block copolymer and monovinylarene-isomonoolefin-monovinylarene block copolymer 中国石油化工股份有限公司 2021-08-03 CN claimed
CN-108314820-B Stretched film and method for producing same 青岛软盛塑业有限公司 2020-09-04 CN claimed
CN-104513326-B Reversible addition-fragmentation chain transfer reagent and preparation and application thereof PETROCHINA COMPANY LIMITED (CN) 2016-05-11 CN claimed
CN-102911369-A Isobutylene/tetrahydrofuran block copolymer and preparation method thereof UNIV BEIJING CHEMICAL 2013-02-06 CN claimed
JP-56043221-A None JP disclosed
CN-119120399-A Cytochrome P450 monooxygenase and application thereof in synthesis of chiral tertiary alcohol 遵义医科大学 2024-12-13 CN disclosed
EP-3214099-B1 METHOD FOR PRODUCING CONJUGATED DIENE POLYMER ZEON CORP (JP) 2024-12-11 EP disclosed
CN-118255955-A Resin, curable resin composition, cured product, resin material for solder resist, insulating material, and resist member DIC株式会社 2024-06-28 CN disclosed
CN-118103414-A Curable resin, curable resin composition, and cured product DIC株式会社 2024-05-28 CN disclosed
CN-117957283-A Resin composition and molded article thereof 帝人株式会社 2024-04-30 CN disclosed
CN-117813331-A Curable resin composition and cured product DIC株式会社 2024-04-02 CN disclosed
US-4399073-A FROM THE HALIDE AND ALKALI METAL CYANATE, WATER AMERICAN CYANAMID COMPANY (US) 1983-08-16 US disclosed
US-4395369-A REACTING ISOCYANIC ACID WITH A TERT-ARALLKYL CHLORIDE OR DICHLORIDE IN A SOLVENT; EFFICIENCY AMERICAN CYANAMID COMPANY (US) 1983-07-26 US disclosed
EP-0083685-A1 Manufacture of diisocyanates AMERICAN CYANAMID COMPANY (US) 1983-07-20 EP disclosed
US-4361518-A REACTION OF TERT-BENZYL HALIDES WITH ISOCYANIC ACID AMERICAN CYANAMID COMPANY (US) 1982-11-30 US disclosed
JP-S5643221-A PREPARATION OF 1,1,3,4,4,6-HEXAMETHYL-1,2,3,4-TETRAHYDRO- NAPHTHALENE KAO CORP 1981-04-21 JP disclosed
US-4045501-A DEHYDROBROMINATING CHLOROMETHYL(1-BROMOETHYL) BENZENES WITH AN AMINE ACCEPTOR EASTMAN KODAK COMPANY (US) 1977-08-30 US disclosed
US-4010188-A Catalytic conversion of saturated hydrocarbons to unsaturated products by oxidation in the presence of a halogen STANDARD OIL COMPANY (US) 1977-03-01 US disclosed