SCHEMBL9753677

SCHEMBL9753677

COC(Cc1cccc2nc(C(=O)O)cn12)c1nnn[nH]1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34

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
SCHEMBL9753978 0.90 GAA (0.35) GAAPTGS1PTGS2
SCHEMBL9753924 0.82
SCHEMBL9753846 0.81
SCHEMBL9753691 0.81 GAA (0.37) GAAPTGS1PTGS2
SCHEMBL9753620 0.78 PTGS1 (0.37) PTGS1PTGS2
SCHEMBL8607323 0.78 GAA (0.42) GAAPTGS1PTGS2
SCHEMBL9753606 0.77
SCHEMBL8607694 0.77 PTGS1 (0.39) GAAPTGS1PTGS2
SCHEMBL9753401 0.75 PTGS1 (0.40) GAAPTGS1PTGS2
SCHEMBL8609715 0.74 PTGS1 (0.36) PTGS1PTGS2

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