SCHEMBL4388647

SCHEMBL4388647

CCOC(=O)C(=C(C#N)c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
MAPT P10636 5/20 0.54
TSHR P16473 1/20 0.50
KMT2A Q03164 5/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
MEN1 O00255 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.43
DHODH Q02127 1/20 0.43
TP53 P04637 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 5/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HSD17B10 Q99714 1/20 0.41
STAT1 P42224 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL2692266 0.83 TSHR (0.48) ALDH1A1MAPTTSHRTP53NPC1
SCHEMBL11857829 0.83 ALDH1A1 (0.62) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
SCHEMBL10899769 0.81 ALDH1A1 (0.50) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
Benzoic Acid SCHEMBL8431579 0.80 ALDH1A1 (0.67) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
Benzoic Acid SCHEMBL28632840 0.80 ALDH1A1 (0.67) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
SCHEMBL5273351 0.79 ALDH1A1 (0.40) ALDH1A1MAPTTSHRKMT2AMAPK1
SCHEMBL28441508 0.79 ALDH1A1 (0.48) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
SCHEMBL29117925 0.78 ALDH1A1 (0.57) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
SCHEMBL20924846 0.78 ALDH1A1 (0.57) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2
SCHEMBL14752765 0.78 ALDH1A1 (0.57) ALDH1A1MAPTTSHRKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107847410-B Sunscreen compositions comprising high levels of liposoluble UV filters 莱雅公司 2024-06-25 CN disclosed
EP-2765145-B1 SILYLATED POLYBUTADIENE NIPPON SODA CO (JP) 2022-03-02 EP disclosed
US-9828448-B2 Silylated polybutadiene NIPPON SODA CO., LTD. (JP) 2017-11-28 US disclosed
EP-2765145-A1 SILYLATED POLYBUTADIENE Nippon Soda Co., Ltd. (JP) 2014-08-13 EP disclosed
US-20140206789-A1 SILYLATED POLYBUTADIENE NIPPON SODA CO., LTD. (JP) 2014-07-24 US disclosed
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-7232857-B2 Radiation hardenable adhesive composition containing dispersed natural rubber fine particles TOPPAN FORMS CO., LTD. (JP) 2007-06-19 US disclosed
EP-1398360-B1 RADIATION HARDENABLE ADHESIVE COMPOSITION CONTAINING DISPERSED NATURAL RUBBER FINE PARTICLES TOPPAN FORMS CO LTD (JP) 2006-08-16 EP disclosed
US-20050080181-A1 Radiation hardenable adhesive composition containing dispersed natural rubber fine particles TOPPAN FORMS CO., LTD. (JP) 2005-04-14 US disclosed
US-6770693-B2 COMPRISING BIS-(2,4-DICUMYLPHENYL) PENTAERYTHRITOL DIPHOSPHITE AND HINDERED PHENOL ANTIOXIDANTS USEFUL AS STABILIZERS AGAINST THERMOOXIDATIVE DEGRADATION OF POLYMERS DURING MELT PROCESSING DOVE CHEMICAL CORPORATION 2004-08-03 US disclosed
EP-1398360-A1 RADIATION HARDENABLE ADHESIVE COMPOSITION CONTAINING DISPERSED NATURAL RUBBER FINE PARTICLES Toppan Forms Co., Ltd (JP) 2004-03-17 EP disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed
US-20020040081-A1 Blends of phosphites and antioxidants DOVER CHEMICAL 2002-04-04 US disclosed