SCHEMBL536253

SCHEMBL536253

CC(CCl)c1ccc(C(C)CCl)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
TAAR1 Q96RJ0 3/20 0.40
ADRB2 P07550 1/20 0.36
AOC3 Q16853 2/20 0.36
ACHE P22303 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
TRPA1 O75762 2/20 0.34
RIPK1 Q13546 1/20 0.34
MIF P14174 1/20 0.34

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
SCHEMBL18045114 0.89 ACHE (0.48) ESR1ESR2TAAR1ACHEALDH1A1
SCHEMBL9345966 0.87 ESR1 (0.34) ESR1ESR2TAAR1ADRB2AOC3
SCHEMBL10281071 0.87 AOC3 (0.38) AOC3ACHEALDH1A1TRPA1
SCHEMBL11239990 0.87 ESR1 (0.59) ESR1ESR2TAAR1ALDH1A1TSHR
SCHEMBL10857961 0.87 GRIA4 (0.43) ESR1ESR2TAAR1ADRB2AOC3
SCHEMBL1304417 0.87 ESR1 (0.43) ESR1ESR2TAAR1ACHEALDH1A1
SCHEMBL2736711 0.86 TAAR1 (0.58) TAAR1AOC3ALDH1A1TSHRTRPA1
SCHEMBL6583604 0.86 TAAR1 (0.58) TAAR1AOC3ALDH1A1TSHRTRPA1
SCHEMBL30750937 0.84 TAAR1 (0.56) TAAR1AOC3ALDH1A1TSHRTRPA1
SCHEMBL11758612 0.83 GRIA4 (0.50) TAAR1AOC3

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
EP-1572766-A4 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEM PATENTS INC (US) 2006-07-26 EP claimed
EP-1578806-A4 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2006-07-19 EP claimed
EP-1572751-A4 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2006-07-19 EP claimed
EP-1578806-A1 POLYMERIZATION PROCESSES ExxonMobil Chemical Patents Inc. (US) 2005-09-28 EP claimed
EP-1572751-A2 POLYMERIZATION PROCESSES ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP claimed
EP-1572766-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP claimed
WO-2004067577-A2 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-08-12 WO claimed
WO-2004058836-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058827-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
EP-0088218-B1 PREPARATION OF TERTIARY ALKYL ISOCYANATES AMERICAN CYANAMID COMPANY (US) 1985-05-08 EP claimed
EP-0083685-B1 MANUFACTURE OF DIISOCYANATES AMERICAN CYANAMID COMPANY (US) 1985-03-06 EP claimed
US-4399073-A FROM THE HALIDE AND ALKALI METAL CYANATE, WATER AMERICAN CYANAMID COMPANY (US) 1983-08-16 US claimed
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 claimed
US-4361518-A REACTION OF TERT-BENZYL HALIDES WITH ISOCYANIC ACID AMERICAN CYANAMID COMPANY (US) 1982-11-30 US claimed
EP-3305822-B1 PROCESS FOR PRODUCING THERMOPLASTIC ELASTOMER, AND THERMOPLASTIC ELASTOMER KANEKA CORP (JP) 2020-08-12 EP disclosed
US-10604598-B2 Method of producing (meth)acryloyl-terminated polyisobutylene polymer KANEKA CORPORATION (JP) 2020-03-31 US disclosed
US-20180362676-A1 METHOD OF PRODUCING (METH)ACRYLOYL-TERMINATED POLYISOBUTYLENE POLYMER KANEKA CORPORATION (JP) 2018-12-20 US disclosed
US-4361518-A REACTION OF TERT-BENZYL HALIDES WITH ISOCYANIC ACID AMERICAN CYANAMID COMPANY (US) 1982-11-30 US disclosed
EP-0009602-A1 Process for preparing indanyl polymers BAYER AG (DE) 1980-04-16 EP disclosed
US-4130577-A FROM THE HALIDE AND AN ALKALI METAL CYANATE SHOWA DENKO K.K. (JP) 1978-12-19 US disclosed