SCHEMBL9686952

SCHEMBL9686952

CC(=O)Nc1cccc(NC(C)=O)c1CO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
MAPK1 P28482 1/20 0.50
TSHR P16473 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.49
MAOA P21397 1/20 0.47
POLB P06746 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 3/20 0.46
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PKM P14618 1/20 0.45
BRD4 O60885 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MAPT P10636 1/20 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
SCHEMBL9687520 0.89 ALDH1A1 (0.61) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL10072797 0.83 MAPK1 (0.55) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL9522714 0.83 SMN1; SMN2 (0.46) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL9377738 0.81 MAPK1 (0.42) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL3940043 0.79 MAPK1 (0.50) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL30168125 0.78 ALDH1A1 (0.59) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL3150784 0.78 ALDH1A1 (0.59) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL8547885 0.77 MAPK1 (0.49) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL50326 0.77 ALDH1A1 (0.52) ALDH1A1HPGDMAPK1TSHRSMN1; SMN2
SCHEMBL9687384 0.77 BRD4 (0.47) ALDH1A1HPGDMAPK1TSHRSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP disclosed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP disclosed