SCHEMBL8610256

SCHEMBL8610256

CCOC(=O)c1cn2c(CCl)cccc2n1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.71
CYP1A2 P05177 3/20 0.51
KDM4E B2RXH2 5/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.47
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
GABRA2 P47869 5/20 0.45
GABRB2 P47870 5/20 0.45
RXFP1 Q9HBX9 1/20 0.44
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL7274660 0.89 GAA (0.75) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL118407 0.88 GAA (0.73) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL12775883 0.85 GAA (0.68) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL8609864 0.85 GAA (0.68) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL118187 0.84 GAA (0.75) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL8607119 0.84 GAA (0.67) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL101291 0.83 GAA (1.00) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL8607711 0.82 GAA (0.64) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL23530875 0.81 GAA (0.75) GAACYP1A2KDM4EPOLBMAPK1
SCHEMBL3033258 0.81 GAA (0.75) GAACYP1A2KDM4EPOLBMAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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