SCHEMBL9753978

SCHEMBL9753978

COC(CCc1cccc2nc(C(=O)O)cn12)c1nnn[nH]1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
PTGS1 P23219 1/20 0.33
PTGS2 P35354 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
SCHEMBL9753677 0.90 GAA (0.37) GAAPTGS1PTGS2
SCHEMBL9753339 0.82
SCHEMBL9753691 0.79 GAA (0.37) GAAPTGS1PTGS2
SCHEMBL9753658 0.79 PTGS1 (0.36) PTGS1PTGS2
SCHEMBL8606427 0.79 GAA (0.41) GAAPTGS1PTGS2
SCHEMBL8608469 0.75 PTGS1 (0.34) PTGS1PTGS2
SCHEMBL8607694 0.75 PTGS1 (0.39) GAAPTGS1PTGS2
SCHEMBL8604762 0.74 RXFP1 (0.32)
SCHEMBL9753401 0.74 PTGS1 (0.40) GAAPTGS1PTGS2
SCHEMBL8606683 0.73 KDM4E (0.31)

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