SCHEMBL20922186

SCHEMBL20922186

COc1cc(NC(C)=O)c(C)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PKM P14618 1/20 0.46
TSHR P16473 2/20 0.45
CYP1A1 P04798 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP1B1 Q16678 1/20 0.45
USP2 O75604 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL3924189 0.89 SMN1; SMN2 (0.54) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL16071797 0.81 HSD17B1 (0.48) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL374670 0.81 HSD17B1 (0.48) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL4293875 0.81 SMN1; SMN2 (0.51) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL9837774 0.81 SMN1; SMN2 (0.60) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL4768199 0.80 GAA (0.41) SMN1; SMN2ALDH1A1MAPTKDM4EMEN1
SCHEMBL7959792 0.78 MAPT (0.50) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL2191052 0.77 HSD17B1 (0.75) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL2502603 0.77 MAPT (0.71) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL30622065 0.77 HSD17B1 (0.75) SMN1; SMN2HSD17B1HSD17B2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3473624-B1 NOVEL IMIDAZOPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER DAEGU GYEONGBUK MEDICAL INNOVATION FOUND (KR) 2022-05-11 EP disclosed
EP-3473624-A1 NOVEL IMIDAZOPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER Daegu-Gyeongbuk Medical Innovation Foundation (KR) 2019-04-24 EP disclosed