SCHEMBL9687429

SCHEMBL9687429

Cc1cccc(NC(=O)CNC(=O)OC(C)(C)C)c1COc1cccnc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
HTT P42858 3/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
ESR2 Q92731 1/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
KDM4E B2RXH2 1/20 0.40
ATM Q13315 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CTDSP1 Q9GZU7 1/20 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
SCHEMBL9686263 0.91 KMT2A (0.48) KMT2ALMNAMEN1GAATHRB
SCHEMBL9686954 0.85 ATM (0.42) KMT2ALMNAMEN1PKML3MBTL1
SCHEMBL9686889 0.84 KMT2A (0.51) KMT2ALMNAMEN1GAATHRB
SCHEMBL9687480 0.84 KMT2A (0.55) KMT2ALMNAMEN1GAATHRB
SCHEMBL9686346 0.81 KMT2A (0.52) KMT2ALMNAMEN1GAATHRB
SCHEMBL9687530 0.80 KMT2A (0.48) KMT2ALMNAMEN1GAATHRB
SCHEMBL9685684 0.78 NPC1 (0.53) KMT2ALMNAMEN1GAATHRB
SCHEMBL9687229 0.78 KMT2A (0.51) KMT2ALMNAMEN1GAATHRB
SCHEMBL10561858 0.76 KMT2A (0.58) KMT2ALMNAMEN1HTTALDH1A1
Pyridine SCHEMBL10560765 0.76 KMT2A (0.48) KMT2ALMNAMEN1GAATHRB

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