SCHEMBL7097494

SCHEMBL7097494

CC(=CCCNC(=O)Nc1ccccc1O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ITGB3 P05106 2/20 0.45
ITGAV P06756 2/20 0.45
MARS1 P56192 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.42
EPHX1 P07099 1/20 0.41
HPGD P15428 1/20 0.41
ITGB1 P05556 1/20 0.40
ITGA5 P08648 1/20 0.40
MMP1 P03956 1/20 0.40

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
SCHEMBL7097491 1.00 GAA (0.46) GAAKMT2AMAPTTDP1KDM4E
SCHEMBL7096385 0.91 MARS1 (0.47) GAAKMT2AMAPTTDP1KDM4E
SCHEMBL7096383 0.91 MARS1 (0.47) GAAKMT2AMAPTTDP1KDM4E
SCHEMBL7097412 0.87 TRPV1 (0.47) GAAKMT2AMAPTKDM4EITGB3
SCHEMBL7097416 0.87 TRPV1 (0.47) GAAKMT2AMAPTKDM4EITGB3
SCHEMBL8547215 0.86 ITGB3 (0.62) GAAKMT2AMAPTKDM4EITGB3
SCHEMBL8547218 0.86 ITGB3 (0.62) GAAKMT2AMAPTKDM4EITGB3
SCHEMBL8546388 0.85 HDAC1 (0.56) KDM4ECA12CA1CA2CA9
SCHEMBL8546383 0.85 HDAC1 (0.56) KDM4ECA12CA1CA2CA9
SCHEMBL8551365 0.84 GOT1 (0.49) KMT2AMAPTITGB3ITGAVALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737896-B1 Photosensitive composition and photosensitive planographic printing plate KODAK POLYCHROME GRAPHICS JP (JP) 2003-08-27 EP disclosed
US-5731127-A WEAR RESISTANCE, SOLVENT RESISTANCE DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-03-24 US disclosed
EP-0737896-A2 Photosensitive composition and photosensitive planographic printing plate DAINIPPON INK AND CHEMICALS, INC. (JP) 1996-10-16 EP disclosed