SCHEMBL9753658

SCHEMBL9753658

COC(CCc1ccc2nc(C(=O)O)cn2c1)c1nnn[nH]1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
EGLN1 Q9GZT9 4/20 0.34
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.31
F11 P03951 2/20 0.30
KLKB1 P03952 2/20 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
SCHEMBL9753620 0.90 PTGS1 (0.37) PTGS1PTGS2EGLN1KDM4EPOLB
SCHEMBL9753569 0.85 PTGS1 (0.39) PTGS1PTGS2EGLN1
SCHEMBL9753808 0.83
SCHEMBL9753856 0.82 APP (0.35)
SCHEMBL8604762 0.81 RXFP1 (0.32)
SCHEMBL8608469 0.80 PTGS1 (0.34) PTGS1PTGS2
SCHEMBL9753527 0.79 PTGS1 (0.41) PTGS1PTGS2EGLN1KDM4EPOLB
SCHEMBL9753978 0.79 GAA (0.35) PTGS1PTGS2
SCHEMBL9753505 0.78 PTGS1 (0.42) PTGS1PTGS2EGLN1KDM4EPOLB
SCHEMBL8608527 0.78 PTGS1 (0.42) PTGS1PTGS2EGLN1KDM4EPOLB

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