SCHEMBL8607290

SCHEMBL8607290

Cc1c(C(=O)O)nc2c(CP(=O)(O)O)cccn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
ACP3 P15309 1/20 0.38
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36
PGK1 P00558 2/20 0.35
PGK2 P07205 2/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL9753950 0.86 ALDH1A1 (0.39) ALDH1A1GAAATP4AATP4BPTGS1
SCHEMBL9753914 0.84 SMN1; SMN2 (0.38) ALDH1A1GAAATP4AATP4BCYP1A2
SCHEMBL9923895 0.78 ALDH1A1 (0.51) ALDH1A1GAAPTGS1PTGS2CYP1A2
SCHEMBL8607403 0.72 ACP3 (0.36) ALDH1A1GAAACP3PGK1PGK2
SCHEMBL8608835 0.71 SMN1; SMN2 (0.48) ALDH1A1GAAPTGS1PTGS2CYP1A2
SCHEMBL7853457 0.70 ATP4A (0.61) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL8607281 0.69 PTGS1 (0.48) ACP3PGK1PGK2PTGS1PTGS2
SCHEMBL8608772 0.69 SMN1; SMN2 (0.49) ALDH1A1PTGS1PTGS2CYP1A2CYP3A4
SCHEMBL11071233 0.69 ACP3 (0.41) ALDH1A1GAAACP3PGK1PGK2
SCHEMBL9081296 0.69 KMT2A (0.46) CYP3A4MAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-5360796-A Treatment of hypoxia, anoxia or ischemia G. D. SEARLE & CO. (US) 1994-11-01 US claimed
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