SCHEMBL7305027

SCHEMBL7305027

O=[N+]([O-])c1c(Nc2ccon2)cnc2c1COCC2

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL7304154 0.80 BACE1 (0.35)
SCHEMBL7300045 0.78
SCHEMBL22529449 0.63 MAPK1 (0.54) NPC1RAB9A
SCHEMBL6776635 0.61 RXFP1 (0.40) RAB9A
SCHEMBL7306938 0.59 BACE1 (0.39)
SCHEMBL31378902 0.58 ALDH1A1 (0.39) RAB9A
SCHEMBL5880375 0.57 WNT3A (0.34)
Hydrochloric Acid SCHEMBL5880349 0.57 WNT3A (0.34)
SCHEMBL7307325 0.55 LIMK1 (0.33)
SCHEMBL29954846 0.54 CCR1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556008-B1 Condensed imidazopyridine derivatives with psychotropic activity SHIONOGI & CO (JP) 1997-05-14 EP disclosed
US-5461062-A Psychotropic agent as antianxiety agent, anesthesia antagonistic agent SHIONOGI & CO., LTD. (JP) 1995-10-24 US disclosed
US-5378848-A Benzodiazepine agonist, psychotropic, antianxiety, cerebral function activator, anesthesia atagonist SHIONOGI & CO., LTD. (JP) 1995-01-03 US disclosed
EP-0556008-A1 Condensed imidazopyridine derivatives with psychotropic activity SHIONOGI & CO., LTD. (JP) 1993-08-18 EP disclosed