SCHEMBL294875

SCHEMBL294875

CC(C)=CC1C(C(=O)OC(C)(C)C)C1(C)C

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.60
TSHR P16473 4/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 3/20 0.46
TDP1 Q9NUW8 3/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX15 P16050 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
MAPK1 P28482 1/20 0.32
ADRA2A P08913 1/20 0.30
CNR1 P21554 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL10828060 0.86 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL294885 0.86 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL9862140 0.86 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL1073358 0.85 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL1073150 0.85 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL2524902 0.85 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL1073355 0.85 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL1073148 0.85 LMNA (0.44) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL9862105 0.84 LMNA (0.42) LMNATSHRCYP1A2CYP2C19TDP1
SCHEMBL10532293 0.84 LMNA (0.42) LMNATSHRCYP1A2CYP2C19TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1607136-B1 OPTICALLY ACTIVE COPPER CATALYST COMPOSITION SUMITOMO CHEMICAL CO (JP) 2012-05-23 EP disclosed
EP-1683782-B1 Chiral copper complex and production processes thereof and using the same SUMITOMO CHEMICAL CO (JP) 2012-03-14 EP disclosed
EP-1683783-B1 Chiral copper complex and production processes thereof and using the same SUMITOMO CHEMICAL CO (JP) 2012-03-14 EP disclosed
EP-1593674-B1 OPTICALLY ACTIVE BISOXAZOLINE COMPOUNDS, PROCESS FOR PRODUCTION OF THE SAME AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2011-07-20 EP disclosed
EP-1797953-B1 PROCESS FOR PRODUCING OXYGENIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2011-01-05 EP disclosed
EP-1253135-B1 Asymmetric copper complex and cyclopropanation reaction using the same SUMITOMO CHEMICAL CO (JP) 2010-11-24 EP disclosed
US-7705165-B2 Method for producing optically active cyclopropanecarboxylate compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-27 US disclosed
US-7683215-B2 Optically active bisoxazoline compounds, process for production of the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-23 US disclosed
US-7671213-B2 Optically active bisoxazoline compounds, process for production of the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
EP-0895992-B1 Copper complexes of optically active bisoxazolines as enantioselective catalysts in cyclopropanation reactions SUMITOMO CHEMICAL CO (JP) 2009-06-10 EP disclosed
US-6072081-A Optically active bisoxazoline compounds, production and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-06 US disclosed
EP-0933349-A1 Method for producing optically active chrysanthemic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-08-04 EP disclosed
EP-0895992-A2 Copper complexes of optically active bisoxazolines as enantioselective catalysts in cyclopropanation reactions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-10 EP disclosed
EP-0891965-A1 Process for producing optically active cyclopropanecarboxylic acid esters SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-01-20 EP disclosed
EP-0128012-B1 NOVEL CHIRAL COPPER COMPLEX AND ASYMMETRIC SYNTHESIS OF CYCLOPROPANECARBOXYLATE DERIVATIVES USING SAID COMPLEX AS CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-11-20 EP disclosed
US-4603218-A Asymmetric synthesis of cyclopropanecarboxylate derivatives using chiral copper complex as catalyst SUMITOMO CHEMICAL CO., LTD. (JP) 1986-07-29 US disclosed
US-4552972-A Chiral copper complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-11-12 US disclosed
EP-0128012-A2 Novel chiral copper complex and asymmetric synthesis of cyclopropanecarboxylate derivatives using said complex as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-12-12 EP disclosed
US-4487955-A ESTERIFICATION, HYDROLYSIS, AND ISOMERIZATION ROUSSEL UCLAF (FR) 1984-12-11 US disclosed
US-4178384-A A 3-DICHLOROVINYL-2,2-DIMETHYL CYCLOPROPANE CARBOXYLATE FMC CORPORATION (US) 1979-12-11 US disclosed