SCHEMBL9753645

SCHEMBL9753645

O=C(O)c1ccn2c(C(=O)O)cnc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
KDM4A O75164 2/20 0.38
KDM5C P41229 2/20 0.38
KDM5B Q9UGL1 2/20 0.38
KDM6B O15054 1/20 0.38
TET3 O43151 1/20 0.38
BBOX1 O75936 1/20 0.38
MAPT P10636 1/20 0.38
KDM5A P29375 1/20 0.38
ASPH Q12797 1/20 0.38
KDM4D Q6B0I6 1/20 0.38
TET2 Q6N021 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
KDM7A Q6ZMT4 1/20 0.38
KDM8 Q8N371 1/20 0.38

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
SCHEMBL17437828 0.89 NPC1 (0.47) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL9941639 0.83 ALDH1A1 (0.44) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL16392277 0.82 KDM4E (0.53) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL30410251 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL29119692 0.81 KDM4E (0.50) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL24460300 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL563331 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL22598519 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL2052844 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL2051117 0.81 KDM4E (0.43) NPC1RAB9AKDM4EALDH1A1GAA

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-0436831-A2 Imidazo[1,2-a]pyridinylalkyl compounds for treatment of neurotoxic injury G.D. Searle & Co. (US) 1991-07-17 EP claimed
WO-1991008211-A1 IMIDAZO[1,2-a]PYRIDINYLALKYL COMPOUNDS FOR TREATMENT OF NEUROTOXIC INJURY G.D. SEARLE & CO. (US) 1991-06-13 WO claimed
EP-0436831-A2 Imidazo[1,2-a]pyridinylalkyl compounds for treatment of neurotoxic injury G.D. Searle & Co. (US) 1991-07-17 EP disclosed
WO-1991008211-A1 IMIDAZO[1,2-a]PYRIDINYLALKYL COMPOUNDS FOR TREATMENT OF NEUROTOXIC INJURY G.D. SEARLE & CO. (US) 1991-06-13 WO disclosed