SCHEMBL9753620

SCHEMBL9753620

COC(Cc1ccc2nc(C(=O)O)cn2c1)c1nnn[nH]1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
EGLN1 Q9GZT9 5/20 0.35
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
METTL3 Q86U44 1/20 0.32
F11 P03951 3/20 0.31
KLKB1 P03952 3/20 0.31
FFAR1 O14842 1/20 0.30
CPB2 Q96IY4 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
SCHEMBL9753658 0.90 PTGS1 (0.36) PTGS1PTGS2EGLN1KDM4EPOLB
SCHEMBL9753527 0.85 PTGS1 (0.41) PTGS1PTGS2EGLN1KDM4EPOLB
SCHEMBL9753526 0.82
SCHEMBL9753460 0.81 APP (0.32) KDM4E
SCHEMBL9753587 0.81 RXFP1 (0.33) PTGS1PTGS2KDM4EPOLB
SCHEMBL9753569 0.78 PTGS1 (0.39) PTGS1PTGS2EGLN1METTL3
SCHEMBL9753677 0.78 GAA (0.37) PTGS1PTGS2
SCHEMBL9753250 0.78 TGFBR1 (0.36)
SCHEMBL8609715 0.77 PTGS1 (0.36) PTGS1PTGS2
SCHEMBL8607702 0.77 PTGS1 (0.43) 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