SCHEMBL7080087

SCHEMBL7080087

C=C(C)C(=O)c1cccc(C(=O)O)c1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PD P11413 1/20 0.53
CASP7 P55210 1/20 0.53
CASP6 P55212 1/20 0.53
MMP2 P08253 1/20 0.44
ALDH1A1 P00352 7/20 0.41
ALOX15 P16050 2/20 0.41
MYC P01106 1/20 0.41
HPGD P15428 5/20 0.40
KDM4E B2RXH2 5/20 0.40
HSD17B10 Q99714 4/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA4 P22748 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
NAPRT Q6XQN6 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 2/20 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
SCHEMBL17799559 0.85 G6PD (0.57) G6PDCASP7CASP6MMP2ALDH1A1
SCHEMBL27604752 0.83 MAPT (0.51) ALDH1A1MYCHSD17B10MEN1KMT2A
SCHEMBL526919 0.82 G6PD (0.74) G6PDCASP7CASP6MMP2ALDH1A1
SCHEMBL27775185 0.81 G6PD (0.58) G6PDCASP7CASP6MMP2ALDH1A1
SCHEMBL30504217 0.81 G6PD (0.58) G6PDCASP7CASP6MMP2ALDH1A1
SCHEMBL11839724 0.81 CD44 (0.42) G6PDCASP7CASP6ALDH1A1MYC
SCHEMBL2489109 0.80 G6PD (0.61) G6PDCASP7CASP6MMP2ALDH1A1
SCHEMBL8604199 0.80 ALDH1A1 (0.61) ALDH1A1ALOX15MYCHPGDKDM4E
SCHEMBL11845879 0.80 CES2 (0.44) G6PDCASP7CASP6ALDH1A1HPGD
SCHEMBL30806223 0.80 G6PD (0.71) G6PDCASP7CASP6MMP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106413665-B Adhering method, bonding kit utility and adhesives 德山齿科株式会社 2019-08-13 CN disclosed
CN-106413665-A Bonding method, bonding kit, and bonding material 德山齿科株式会社 2017-02-15 CN disclosed
CN-101223252-B Phenylazo-acetoacetanilide derivatives having polymerizable functional group as monomer for preparing polymeric pigment dispersant for ink jet ink and related compounds AGFA GRAPHICS N.V. (BE) 2015-11-25 CN disclosed
CN-101223252-A Phenylazo-acetoacetanilide derivatives having polymerizable functional group as monomer for preparing polymeric pigment dispersant for ink jet ink and related compounds AGFA GRAPHICS NV (BE) 2008-07-16 CN disclosed
EP-0811368-B1 DENTAL PRIMER COMPOSITION AND POLYMERIZATION CATALYST TOKUYAMA CORP (JP) 2003-07-23 EP disclosed
US-20030021940-A1 Optical recording medium and method for producing the same SONY CORPORATION (JP) 2003-01-30 US disclosed
EP-1158505-A1 OPTICAL RECORDING MEDIUM AND METHOD FOR PRODUCING THE SAME Sony Corporation (JP) 2001-11-28 EP disclosed
EP-0811368-A1 DENTAL PRIMER COMPOSITION AND POLYMERIZATION CATALYST TOKUYAMA CORPORATION (JP) 1997-12-10 EP disclosed