SCHEMBL7095560

SCHEMBL7095560

CCC(CC)(Cc1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SLC6A2 P23975 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
TP53 P04637 1/20 0.44
LMNA P02545 1/20 0.43
CYP2D6 P10635 1/20 0.43
KIF11 P52732 2/20 0.40
KCNN4 O15554 1/20 0.40
KCNA5 P22460 1/20 0.39
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39
TRPA1 O75762 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL9063882 0.85 CYP1A2 (0.58) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL2170468 0.83 KCNN4 (0.48) CYP1A2CYP2C9CYP2C19TAAR1TP53
SCHEMBL8157569 0.83 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL27649423 0.80 KCNN4 (0.46) CYP1A2CYP2C9CYP2C19TAAR1TP53
SCHEMBL2049764 0.79 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL16835577 0.77 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL10601326 0.77 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL56557 0.77 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL812502 0.77 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL29151818 0.77 SIGMAR1 (0.44) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109265310-A A kind of organic blue fluorescent material and its preparation method and application 陕西师范大学 2019-01-25 CN disclosed
US-20030013902-A1 Solvents for trialkoxysilane synthesis BASF AKTIENGESELLSCHAFT (DE) 2003-01-16 US disclosed
EP-1242428-A1 SOLVENT FOR TRIALKOXYSILANE SYNTHESIS BASF AKTIENGESELLSCHAFT (DE) 2002-09-25 EP disclosed
US-6410771-B1 REACTING SILICON METAL WITH AN ALCOHOL IN AN INERT SOLVENT INPRESENCE OF A COPPER CATALYST, WHEREIN COPPER CATALYST USED IS A COPPER SALT WHOSE ANION CONTAINS NONHYDROLYZABLE FLUORINE ATOM, OR A MIXTURE WITH OTHER COPPER SALTS BASF AKTIENGESELLSCHAFT (DE) 2002-06-25 US disclosed
US-6380414-B2 REACTING SILICON METAL WITH ALCOHOL BASF AKTIENGESELLSCHAFT (DE) 2002-04-30 US disclosed
US-20020022735-A1 Fluorinated copper salts as catalysts for the synthesis of trialkoxysilanes BASF AKTIENGESELLSCHAFT (DE) 2002-02-21 US disclosed
US-20020010354-A1 Freshly precipitated CuO as catalyst for the trialkoxysilane synthesis BASF AKTIENGESELLSCHAFT (DE) 2002-01-24 US disclosed
EP-1172366-A2 Fluorinated copper salts for the synthesis of trialkoxy silanes BASF AKTIENGESELLSCHAFT (DE) 2002-01-16 EP disclosed
EP-1157993-A2 Process for preparing trialkoxysilanes using freshly precipitated CuO as catalyst BASF AKTIENGESELLSCHAFT (DE) 2001-11-28 EP disclosed
WO-2001047937-A1 SOLVENT FOR TRIALKOXYSILANE SYNTHESIS BASF AKTIENGESELLSCHAFT (DE) 2001-07-05 WO disclosed
US-5210355-A Ethylation of 2-methylnaphthalene with tri-, tetra-, or penta-ethylbenzene in the presence of a catalyst AMOCO CORPORATION (US) 1993-05-11 US disclosed
US-5177286-A Selective production of a p-alkyltoluene or 4,4'-alkylmethylbiphenyl AMOCO CORPORATION (US) 1993-01-05 US disclosed
US-5171917-A Ethylation of benzene, toluene, ethylbenzene or a mixture of benzene and ethylbenzene with 1,2,4-triethylbenezene, tetra- or pentaethylbenzene in the presence of an acid catalys catalyst AMOCO CORPORATION (US) 1992-12-15 US disclosed
EP-0487714-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-06-03 EP disclosed
WO-1992000260-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-01-09 WO disclosed
EP-0282064-B1 METHOD FOR PRODUCING M-ETHYLDIPHENYLS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-10-23 EP disclosed
US-4835337-A Method for producing m-ethyldiphenyls NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-05-30 US disclosed
EP-0282064-A1 Method for producing m-ethyldiphenyls NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-14 EP disclosed
EP-0029645-B1 USE OF DIPHENYLETHANE DERIVATIVE AS SOLVENT FOR COLOUR-FORMER IN PRESSURE-SENSITIVE RECORDING MATERIALS; SOLUTIONS, MICROCAPSULES, SHEETS COATED WITH MICROCAPSULES AND PRESSURE-SENSITIVE RECORDING MATERIALS CONTAINING SAID SOLVENT; METHOD OF COPYING USING SAID SHEETS OR RECORDING MATERIALS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-07-20 EP disclosed
EP-0029645-A2 Use of diphenylethane derivative as solvent for colour-former in pressure-sensitive recording materials; solutions, microcapsules, sheets coated with microcapsules and pressure-sensitive recording materials containing said solvent; method of copying using said sheets or recording materials KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1981-06-03 EP disclosed