SCHEMBL8607403

SCHEMBL8607403

O=C(O)c1cnc2c(CP(=O)(O)O)cccn12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.36
MAPT P10636 2/20 0.33
EPHB3 P54753 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
TP53 P04637 1/20 0.33
HDAC8 Q9BY41 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL15869590 0.84 CLCN2 (0.38) MAPTTP53HDAC8ALDH1A1GAA
SCHEMBL1290914 0.84 BAZ2B (0.38) MAPTEPHB3TP53HDAC8ALDH1A1
SCHEMBL15670600 0.80 MAPT (0.36) MAPTTP53HDAC8ALDH1A1GAA
SCHEMBL1290844 0.77 EGLN1 (0.42) MAPTTP53HDAC8ALDH1A1
SCHEMBL25395169 0.74 HDAC8 (0.50) MAPTEPHB3HDAC8ALDH1A1GAA
SCHEMBL1290630 0.74 PRMT5 (0.36) MAPTEPHB3HDAC8ALDH1A1GAA
SCHEMBL2498109 0.74 ALDH1A1 (0.51) MAPTTP53HDAC8ALDH1A1GAA
SCHEMBL8607290 0.72 ALDH1A1 (0.40) ACP3MAPTPGK1PGK2ALDH1A1
SCHEMBL8607018 0.72 ATP4A (0.30)
SCHEMBL24857446 0.71 ALDH1A1 (0.36) MAPTHDAC8ALDH1A1GAAHPGD

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 7 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
US-5716964-A BRAIN DISORDERS; ANTIISCHEMIC AGENTS G.D. SEARLE & CO. (US) 1998-02-10 US disclosed
US-5633237-A Imidazo[1,2-a]pyridinylalkyl phosphonic acid compounds for treatment of neurotoxic injury G.D. SEARLE & CO. (US) 1997-05-27 US disclosed
US-5360796-A Treatment of hypoxia, anoxia or ischemia G. D. SEARLE & CO. (US) 1994-11-01 US disclosed
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