SCHEMBL9569994

SCHEMBL9569994

[O]CCc1nc2ncncc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
NPY5R Q15761 1/20 0.34
ENPP1 P22413 1/20 0.33
ITGB3 P05106 1/20 0.32
ITGAV P06756 1/20 0.32
PI4KA P42356 1/20 0.32
PI4K2B Q8TCG2 1/20 0.32
PI4K2A Q9BTU6 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
NOS1 P29475 2/20 0.31
NOS2 P35228 2/20 0.31
NOS3 P29474 1/20 0.31
GRIN2B Q13224 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
CYP2C9 P11712 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
SCHEMBL4955472 0.86 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL9936013 0.86 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL6485 0.83 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL30884953 0.83 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL29208955 0.83 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL10852261 0.82 METAP2 (0.39) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL7073073 0.80 RAD52 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL7851163 0.80 PI4KA (0.49) METAP2METAP1NPY5RPI4KAPI4K2B
SCHEMBL3691689 0.79 PI4KA (0.55) METAP2METAP1PI4KAPI4K2BPI4K2A
SCHEMBL5062499 0.79 METAP2 (0.39) METAP2METAP1NPY5RPI4KAPI4K2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5270322-A Imidazo[1,2-a]pyridines, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1993-12-14 US disclosed
EP-0555825-A1 Imidazo(1,2-a)pyridines as angiotensin-II-antagonists Dr. Karl Thomae GmbH (DE) 1993-08-18 EP disclosed