SCHEMBL8607484

SCHEMBL8607484

O=C(O)c1cn2c(-c3nnn[nH]3)c(Cl)ccc2n1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30
NOTUM Q6P988 1/20 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
SCHEMBL8605299 0.86 PTGS1 (0.35) PTGS1PTGS2
SCHEMBL8609356 0.82 PTGS1 (0.34) PTGS1PTGS2
SCHEMBL8609966 0.82 KDM4E (0.38) PTGS1PTGS2
SCHEMBL8610197 0.80
SCHEMBL8604897 0.79
SCHEMBL9753444 0.77 PTGS1 (0.32) PTGS1PTGS2
SCHEMBL8608914 0.77 PTGS1 (0.32) PTGS1PTGS2
SCHEMBL8610010 0.77 PTGS1 (0.41) PTGS1PTGS2
SCHEMBL9753756 0.76
SCHEMBL8609452 0.75 CDK2 (0.32)

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 5 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
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