SCHEMBL2701443

SCHEMBL2701443

CCCCCCCOCC1CCCO1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.56
PDK1 Q15118 1/20 0.49
EPHX1 P07099 1/20 0.48
TSHR P16473 1/20 0.48
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
CES2 O00748 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
SCHEMBL2698852 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL27834079 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL28004276 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL5935772 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL28003819 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL23849829 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL2701059 1.00 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL2700383 0.98 ALDH1A1 (0.65) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL31139039 0.96 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1
SCHEMBL13423663 0.95 ALDH1A1 (0.66) ALDH1A1TDP1SMN1; SMN2PDK1EPHX1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604143-B2 Catalysts for polymerization of isoprene and preparations and uses thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2013-12-10 US claimed
US-20120108773-A1 CATALYSTS FOR POLYMERIZATION OF ISOPRENE AND PREPARATIONS AND USES THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2012-05-03 US claimed
CN-106928415-B Composite coupler and application and monovinylarene-conjugated diene copolymer composition and preparation method and tire 中国石油化工股份有限公司 2019-06-28 CN disclosed
CN-104628951-B A kind of anionic polymerisation structure regulator and a kind of anionic polymerisation process 中国石油化工股份有限公司 2017-08-25 CN disclosed
CN-105622785-B A kind of composite coupler and application and a kind of monovinylarene conjugated diene coupled copolymers and preparation method and application 中国石油化工股份有限公司 2017-06-30 CN disclosed
CN-104628896-B Method for improving coupling efficiency of solution polymerized styrene-butadiene rubber 中国石油化工股份有限公司 2017-04-26 CN disclosed
CN-105622785-A Composite coupling agent and application and monovinylarene-conjugated dialkene coupled copolymer and preparation method and application CHINA PETROLEUM & CHEM CORP 2016-06-01 CN disclosed
CN-104628951-A Structure regulator for anionic polymerization and anionic polymerization method CHINA PETROLEUM & CHEMICAL 2015-05-20 CN disclosed
CN-104628896-A Method for improving coupling efficiency of solution polymerized styrene-butadiene rubber CHINA PETROLEUM & CHEMICAL 2015-05-20 CN disclosed
CN-104558410-A Structure modifier for anionic polymerization and anionic polymerization method CHINA PETROLEUM & CHEMICAL 2015-04-29 CN disclosed
US-8604143-B2 Catalysts for polymerization of isoprene and preparations and uses thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2013-12-10 US disclosed
US-20120108773-A1 CATALYSTS FOR POLYMERIZATION OF ISOPRENE AND PREPARATIONS AND USES THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2012-05-03 US disclosed