SCHEMBL9685684

SCHEMBL9685684

Cc1cccc(NC(=O)OCc2ccccc2)c1COc1cccnc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RAB9A P51151 3/20 0.53
KMT2A Q03164 5/20 0.52
MEN1 O00255 3/20 0.51
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
THRB P10828 1/20 0.46
HTT P42858 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
ESR2 Q92731 1/20 0.45
PPIA P62937 4/20 0.44
PPIF P30405 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MITF O75030 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL9687480 0.89 KMT2A (0.55) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL9686263 0.85 KMT2A (0.48) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL9687530 0.85 KMT2A (0.48) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL9686367 0.84 NPC1 (0.57) NPC1RAB9AKMT2AMEN1HTT
SCHEMBL9686889 0.83 KMT2A (0.51) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL3237870 0.82 NPC1 (0.54) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL9686346 0.82 KMT2A (0.52) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL9687229 0.81 KMT2A (0.51) NPC1RAB9AKMT2AMEN1LMNA
Pyridine SCHEMBL10560765 0.80 KMT2A (0.48) NPC1RAB9AKMT2AMEN1LMNA
SCHEMBL10561858 0.79 KMT2A (0.58) NPC1RAB9AKMT2AMEN1LMNA

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