SCHEMBL7093312

SCHEMBL7093312

CNC(=O)Nc1ccc(C)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
KMT2A Q03164 3/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 2/20 0.57
CYP2C19 P33261 2/20 0.57
MEN1 O00255 1/20 0.57
CYP3A4 P08684 1/20 0.57
GAA P10253 1/20 0.57
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 4/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
CA2 P00918 1/20 0.44
MAPT P10636 2/20 0.44

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
SCHEMBL11563350 0.85 POLB (0.53) ALDH1A1KMT2ANPC1RAB9APOLB
SCHEMBL13804531 0.85 ALDH1A1 (0.55) ALDH1A1KMT2APOLBKDM4EHPGD
SCHEMBL11750528 0.85 POLB (0.63) ALDH1A1KMT2ACYP1A2GAANPC1
SCHEMBL2853227 0.82 ALDH1A1 (0.64) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL7093860 0.82 KMT2A (0.61) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL13411694 0.81 MAPT (0.59) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL8537529 0.81 ALDH1A1 (0.62) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL11755742 0.80 SMN1; SMN2 (0.69) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL19049142 0.80 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1CYP3A4GAA
SCHEMBL2680742 0.80 EPHX1 (0.71) KMT2ACYP1A2CYP2D6CYP2C9CYP2C19

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