SCHEMBL6489760

SCHEMBL6489760

CC(C)(C)c1cccc(C(C)(C)C)c1-c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.54
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
SENP1 Q9P0U3 1/20 0.45
LMNA P02545 2/20 0.44
TYR P14679 2/20 0.44
HSD17B10 Q99714 3/20 0.43
NR1I2 O75469 1/20 0.43
CYP2C9 P11712 1/20 0.43
MIF P14174 1/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
NFE2L2 Q16236 1/20 0.43
ESR1 P03372 7/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43

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
SCHEMBL28607700 0.98 CA2 (0.52) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28268413 0.88 GABRA1 (0.55) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28874153 0.84 PDE4A (0.46) CA2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL7858676 0.83 TYR (0.54) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL10495887 0.82 PARP1 (0.41) CA2GABRA1GABRB2ALDH1A1TDP1
SCHEMBL28285264 0.82 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL27770127 0.81 ESR1 (0.42) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL29131482 0.81 CA2 (0.40) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL27743898 0.80 CA2 (0.57) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL27908556 0.80 CA2 (0.44) CA2GABRA1GABRB2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459537-A stable resin composition SABIC环球技术有限责任公司 2017-02-22 CN claimed
JP-61051002-A None JP disclosed
EP-3889186-B1 SULFUR-MODIFIED CHLOROPRENE RUBBER, METHOD FOR PRODUCING SAME, SULFUR-MODIFIED CHLOROPRENE RUBBER COMPOSITION, VULCANIZED PRODUCT AND MOLDED ARTICLE DENKA COMPANY LTD (JP) 2022-09-28 EP disclosed
EP-3889186-A1 SULFUR-MODIFIED CHLOROPRENE RUBBER, METHOD FOR PRODUCING SAME, SULFUR-MODIFIED CHLOROPRENE RUBBER COMPOSITION, VULCANIZED PRODUCT AND MOLDED ARTICLE Denka Company Limited (JP) 2021-10-06 EP disclosed
CN-107434926-B Coating compositions and methods for containers and other articles 宣伟投资管理有限公司 2021-04-06 CN disclosed
CN-110506224-A Composition for solid-state imaging element and method for forming infrared shielding film for solid-state imaging element JSR CORP 2019-11-26 CN disclosed
CN-105829509-B Purposes of the alkoxylated PolyTHF as fuel additive 巴斯夫欧洲公司 2018-07-13 CN disclosed
CN-108026470-A The lubricating composition of the new alkylation diphenylamine derivatives of triazole and the new alkylation diphenylamine derivatives containing the triazole 范德比尔特化学品有限责任公司 2018-05-11 CN disclosed
CN-108026467-A Improved antioxidant composition and lubricating composition containing the same 范德比尔特化学品有限责任公司 2018-05-11 CN disclosed
CN-105593235-B The production method of group with imine moiety, catalyst for olefines polymerizing and olefin polymer 日本聚丙烯株式会社 2018-04-10 CN disclosed
EP-0150640-B1 PROCESS FOR THE POLYMERISATION OF CHLOROPRENE DISTUGIL (FR) 1988-06-01 EP disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
JP-S6151002-A PRODUCTION OF VINYL POLYMER SHIN ETSU CHEM CO LTD 1986-03-13 JP disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
US-4339372-A Process of preparing stabilized polychloroprene latex DISTUGIL (FR) 1982-07-13 US disclosed
US-4247427-A Adhesion promoted block copolyester composition with multi-functional carboxylic compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-01-27 US disclosed
US-4156702-A Adhesion promoted block copolyester composition with multi-functional carboxylic compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-05-29 US disclosed
US-4048128-A ALKALINE EARTH OXIDE, POLYCARBODIIMIDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-13 US disclosed
US-RE29157-E High temperature resistant polychloroprene adhesive resin SCHENECTADY CHEMICALS, INC. (US) 1977-03-22 US disclosed
US-3969294-A Segmented copolyester adhesives stabilized by alkaline earth oxides and carboxylic compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-07-13 US disclosed