SCHEMBL5164988

SCHEMBL5164988

Cc1cccc(/C=C/C#N)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.56
PTGS1 P23219 3/20 0.50
PTGS2 P35354 3/20 0.50
ALOX5 P09917 1/20 0.50
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
RELA Q04206 2/20 0.49
FBP1 P09467 1/20 0.49
NPC1 O15118 3/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
KDM4E B2RXH2 2/20 0.44
FDPS P14324 1/20 0.42
ACHE P22303 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
NFE2L2 Q16236 1/20 0.39
NR1H3 Q13133 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
SCHEMBL5164991 1.00 ENPP2 (0.56) ENPP2PTGS1PTGS2ALOX5TP53
SCHEMBL10847619 0.87 PTGS1 (0.46) ENPP2PTGS1PTGS2ALOX5TP53
SCHEMBL1795132 0.80 PTGS1 (0.69) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL21847980 0.80 PTGS1 (0.69) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL1795130 0.80 PTGS1 (0.69) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL2345285 0.80 FBP1 (0.53) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL2345287 0.80 FBP1 (0.53) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL7218728 0.79 TP53 (0.54) PTGS1PTGS2ALOX5TP53TDP1
SCHEMBL501533 0.79 KDM4E (0.45) ENPP2PTGS1PTGS2ALOX5TP53
SCHEMBL501534 0.79 KDM4E (0.45) ENPP2PTGS1PTGS2ALOX5TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
CN-110248971-B Copolymer and optical film using the same 东曹株式会社 2021-11-02 CN disclosed
US-20200095358-A1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORPORATION (JP) 2020-03-26 US disclosed
EP-3553097-A1 COPOLYMER AND OPTICAL FILM USING SAME Tosoh Corporation (JP) 2019-10-16 EP disclosed
CN-110248971-A Copolymer and the optical film for using the copolymer 东曹株式会社 2019-09-17 CN disclosed
US-9067928-B2 Compounds and methods of use ABBVIE INC. (US) 2015-06-30 US disclosed
US-8518970-B2 Compounds and methods of use ABBVIE INC. (US) 2013-08-27 US disclosed
CN-100558698-C Calcium Receptor Active Compounds NPS PHARMA INC (US) 2009-11-11 CN disclosed
EP-0787122-B9 CALCIUM RECEPTOR-ACTIVE COMPOUNDS NPS PHARMA INC (US) 2007-10-17 EP disclosed
CN-1147459-C Calcium Receptor Active Compounds NPSҩ�����޹�˾ 2004-04-28 CN disclosed
EP-1275635-A1 Calcium receptor-active compounds NPS PHARMACEUTICALS, INC. (US) 2003-01-15 EP disclosed
EP-1203761-A2 Calcium receptor-active compounds NPS PHARMACEUTICALS, INC. (US) 2002-05-08 EP disclosed
US-6211244-B1 AROMATIC AMINES FOR COMPLEXING CALCIUM NPS PHARMACEUTICALS, INC. 2001-04-03 US disclosed
WO-1996012697-A9 CALCIUM RECEPTOR-ACTIVE COMPOUNDS NPS PHARMA INC (US) 2000-08-24 WO disclosed
CN-1220658-A Calcium Receptor Active Compounds NPS PHARMA INC (US) 1999-06-23 CN disclosed
EP-0787122-A2 CALCIUM RECEPTOR-ACTIVE COMPOUNDS NPS PHARMACEUTICALS, INC. (US) 1997-08-06 EP disclosed
WO-1996012697-A2 CALCIUM RECEPTOR-ACTIVE COMPOUNDS NPS PHARMACEUTICALS, INC. (US) 1996-05-02 WO disclosed
US-4354981-A Method for synthesizing dinitriles, products obtained thereby and their derivatives ANIC, S.P.A. (IT) 1982-10-19 US disclosed
US-4279834-A REACTING AN ALPHA, BETA SATURATED VITRILE WITH AN ALPHA, BETA UNSATURATED NITRILE ANIC S.P.A. (IT) 1981-07-21 US disclosed