SCHEMBL3976672

SCHEMBL3976672

N#C/C=C/c1ccccc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
BACE1 P56817 1/20 0.40
FLT3 P36888 2/20 0.36
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
BCL2L1 Q07817 1/20 0.35
CYP2A6 P11509 1/20 0.35
MAPK1 P28482 1/20 0.35
PTGER1 P34995 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
PELI1 Q96FA3 1/20 0.34
MAP3K7 O43318 1/20 0.33

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
SCHEMBL4370207 1.00 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31330770 1.00 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9251227 0.94 FLT3 (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9251224 0.94 FLT3 (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11125534 0.94 ESR2 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1342965 0.85 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29203723 0.85 ESR2 (0.51) BACE1BCL2L1PTGER1PTGER3PTGER2
SCHEMBL7931796 0.85 HPGD (0.38) ALDH1A1HSD17B10HPGDMAPK1
SCHEMBL11293055 0.85 KDM4E (0.43) BACE1PTGER1PTGER3PTGER2HDAC3
SCHEMBL28285681 0.85 ESR2 (0.51) BACE1BCL2L1PTGER1PTGER3PTGER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119315086-A Nitrile additives for electrolytes of batteries including lithium-rich manganese positive electrodes 通用汽车环球科技运作有限责任公司 2025-01-14 CN claimed
CN-112479930-B Alpha-phenyl cinnamonitrile derivative and preparation method and application thereof 洛阳师范学院 2023-04-28 CN claimed
CN-119315086-A Nitrile additives for electrolytes of batteries including lithium-rich manganese positive electrodes 通用汽车环球科技运作有限责任公司 2025-01-14 CN disclosed
CN-113528593-B Method for preparing alpha-phenyl cinnamonitrile derivative based on mechanical ball milling-enzyme catalytic coupling technology 浙江工业大学 2024-02-02 CN disclosed
CN-112479930-B Alpha-phenyl cinnamonitrile derivative and preparation method and application thereof 洛阳师范学院 2023-04-28 CN disclosed
US-10561597-B2 Use in cosmetics of polymers obtained by low-concentration, inverse emulsion polymerisation with a low level of neutralised monomers S.P.C.M. SA (FR) 2020-02-18 US disclosed
US-20190209453-A1 USE IN COSMETICS OF POLYMERS OBTAINED BY LOW-CONCENTRATION, INVERSE EMULSION POLYMERISATION WITH A LOW LEVEL OF NEUTRALISED MONOMERS S.P.C.M. SA (FR) 2019-07-11 US disclosed
EP-3055031-B1 USE OF POLYMERS OBTAINED BY LOW-CONCENTRATION INVERSE EMULSION POLYMERIZATION SPCM SA (FR) 2019-03-13 EP disclosed
US-20160228348-A1 USE IN COSMETICS OF POLYMERS OBTAINED BY LOW-CONCENTRATION, INVERSE EMULSION POLYMERISATION WITH A LOW LEVEL OF NEUTRALISED MONOMERS S.P.C.M. SA (FR) 2016-08-11 US disclosed
US-20090130849-A1 CHEMICAL MECHANICAL POLISHING AND WAFER CLEANING COMPOSITION COMPRISING AMIDOXIME COMPOUNDS AND ASSOCIATED METHOD FOR USE EKC TECHNOLOGY, INC. 2009-05-21 US disclosed
WO-2009058274-A1 CHEMICAL MECHANICAL POLISHING AND WAFER CLEANING COMPOSITION COMPRISING AMIDOXIME COMPOUNDS AND ASSOCIATED METHOD FOR USE EKC TECHNOLOGY, INC. (US) 2009-05-07 WO disclosed
WO-2009058275-A1 METHODS OF POST CHEMICAL MECHANICAL POLISHING AND WAFER CLEANING USING AMIDOXIME COMPOSITIONS EKC TECHNOLOGY, INC. (US) 2009-05-07 WO disclosed
WO-2009058278-A1 METHODS OF CLEANING SEMICONDUCTOR DEVICES AT THE BACK END OF LINE USING AMIDOXIME COMPOSITIONS EKC TECHNOLOGY, INC (US) 2009-05-07 WO disclosed
WO-2009058272-A1 COPPER CMP POLISHING PAD CLEANING COMPOSITION COMPRISING OF AMIDOXIME COMPOUNDS EKC TECHNOLOGY, INC. (US) 2009-05-07 WO disclosed
CN-1656135-A Breathable polyurethanes, blends, and articles NOVEON IP HOLDINGS CORP (US) 2005-08-17 CN disclosed
US-5238965-A Topical application of cyclic or acyclic derivatives which may contain thio ester or mercapto-substituents THE PROCTER & GAMBLE COMPANY (US) 1993-08-24 US disclosed
US-4116997-A METHOD FOR THE PREPARATION OF CARBONIC ACID MONOESTER SALTS ANIC, S.P.A. (IT) 1978-09-26 US disclosed