SCHEMBL270167

SCHEMBL270167

CCc1ccc(C)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
PDE2A O00408 1/20 0.44
RAPGEF4 Q8WZA2 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
ALOX5 P09917 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
TP53 P04637 2/20 0.39
SKP2 Q13309 1/20 0.39

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
SCHEMBL29441542 1.00 TRPA1 (0.48) TRPA1CYP1A2CYP2A6PDE2ARAPGEF4
Ammonia Solution, Strong SCHEMBL27619214 0.97 TRPA1 (0.46) TRPA1CYP1A2CYP2A6PDE2ARAPGEF4
SCHEMBL18919877 0.83 TAAR1 (0.46) TRPA1RAPGEF4ALDH1A1MAPTSMN1; SMN2
Nitric Acid SCHEMBL28957037 0.83 ALDH1A1 (0.47) TRPA1PDE2AALDH1A1ESR1ESR2
SCHEMBL10906702 0.82 RAPGEF4 (0.40) TRPA1CYP1A2CYP2A6PDE2ARAPGEF4
SCHEMBL8750379 0.82 PDE2A (0.38) TRPA1CYP1A2CYP2A6PDE2ARAPGEF4
SCHEMBL137449 0.80 MCL1 (0.40) CYP2A6ALDH1A1ALOX5PTGS1PTGS2
SCHEMBL311076 0.80 ESR1 (0.61) CYP1A2ALDH1A1ESR1ESR2LMNA
SCHEMBL311370 0.80 PTGS1 (0.45) CYP1A2ALDH1A1ESR1ESR2PTGS1
SCHEMBL30876036 0.80 ESR1 (0.61) CYP1A2ALDH1A1ESR1ESR2LMNA

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 1388 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109891614-B Solvent system for preparing photosensitive organic electronic device 住友化学株式会社 2024-04-30 CN claimed
CN-115924853-B High-yield working liquid system for producing hydrogen peroxide by anthraquinone process 黎明化工研究设计院有限责任公司 2024-01-05 CN claimed
US-11778843-B2 Light-emitting device and manufacturing method of light-emitting device SHARP KABUSHIKI KAISHA (JP) 2023-10-03 US claimed
CN-109890800-B Process for recovering furfural 国际壳牌研究有限公司 2023-05-23 CN claimed
CN-115924853-A High-energy-yield working liquid system for producing hydrogen peroxide by anthraquinone process 黎明化工研究设计院有限责任公司 2023-04-07 CN claimed
CN-114667279-A Heat-sensitive recording material containing non-phenol color developer 索理思科技开曼公司 2022-06-24 CN claimed
CN-114599746-A Nanostructured ink compositions for ink jet printing 纳米系统公司 2022-06-07 CN claimed
US-20220037604-A1 LIGHT-EMITTING DEVICE AND MANUFACTURING METHOD OF LIGHT-EMITTING DEVICE SHARP KABUSHIKI KAISHA (JP) 2022-02-03 US claimed
US-20220034100-A1 Installation of Floorcovering Article on Chemically Abated Flooring Surface and Composite Article MILLIKEN & COMPANY 2022-02-03 US claimed
CN-113396137-A Method for producing 1,1, 1-trifluoro-2, 2-bisarylethane, and 1,1, 1-trifluoro-2, 2-bisarylethane 中央硝子株式会社 2021-09-14 CN claimed
US-5334335-A Solid polish, water and organic solvent CLEARFIX CORPORATION (US) 1994-08-02 US claimed
WO-1994008756-A1 COMPOSITIONS AND METHODS FOR REPAIRING PLASTIC SURFACES CLEARFIX CORPORATION (US) 1994-04-28 WO claimed
US-4652691-A Selective ethylation of xylene with a metal-modified, crystalline borosilicate molecular sieve AMOCO CORPORATION (US) 1987-03-24 US claimed
EP-0200360-A1 Process for the separation of C10 aromatic isomers EXXON CHEMICAL PATENTS INC. (US) 1986-11-05 EP claimed
US-4584422-A USING CRYSTALLING ZEOLITE ZSM-5 CATALYST MOBIL OIL CORPORATION (US) 1986-04-22 US claimed
EP-0021600-B1 SELECTIVE ALKYLATION OF XYLENES WITH ETHYLENE MOBIL OIL CORPORATION (US) 1983-02-02 EP claimed
EP-0021600-A1 Selective alkylation of xylenes with ethylene MOBIL OIL CORPORATION (US) 1981-01-07 EP claimed
US-4070364-A Process for the production of [2-acetoacetyl-aminothiazolyl-(4)-]-acetic acid ethyl ester LONZA, LTD. (CH) 1978-01-24 US claimed
US-4018828-A SOLIDIFICATION GULF RESEARCH & DEVELOPMENT COMPANY (US) 1977-04-19 US claimed
US-3962357-A FROM SUBSTITUTED ETHYLTOLUENE, CONTINUOUS, SINGLE STEP ROHM AND HAAS COMPANY (US) 1976-06-08 US claimed