SCHEMBL8608014

SCHEMBL8608014

COc1ccc2nc(P(=O)(O)O)cn2c1P(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CG P48736 1/20 0.33
EPHB3 P54753 1/20 0.32
ALDH1A3 P47895 1/20 0.32
POLB P06746 3/20 0.31
ALDH1A1 P00352 5/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 6/20 0.31
SMN1; SMN2 Q16637 4/20 0.31
RAB9A P51151 3/20 0.31
LMNA P02545 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
FBP1 P09467 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NPC1 O15118 2/20 0.30
HTT P42858 2/20 0.30
KLK7 P49862 1/20 0.30
ATM Q13315 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
SCHEMBL8607467 0.82 KDM4E (0.37) PIK3CDPIK3CAPIK3CGEPHB3POLB
SCHEMBL8606516 0.78
SCHEMBL8605939 0.77 MMP1 (0.33) EPHB3POLBALDH1A1
SCHEMBL8606971 0.75
SCHEMBL9753705 0.68 FBP1 (0.34) ALDH1A1KDM4EFBP1NPC1HPGD
SCHEMBL9753608 0.68
SCHEMBL8607745 0.68 ALDH1A1 (0.32) POLBALDH1A1
SCHEMBL9753831 0.67 GAA (0.31) RXFP1
SCHEMBL8609449 0.66 RXFP1 (0.33) EPHB3POLBALDH1A1RXFP1
SCHEMBL8608867 0.66 SLC2A1 (0.32) POLBALDH1A1

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
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