SCHEMBL9635700

SCHEMBL9635700

N#CCOc1ccc(-c2nc3ncccc3[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.65
AURKA O14965 6/20 0.65
HPSE Q9Y251 1/20 0.51
FAAH O00519 1/20 0.48
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
PDE2A O00408 1/20 0.46

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
SCHEMBL9634908 0.87 PRMT5 (0.65) PRMT5AURKAHPSEFAAHMETAP2
SCHEMBL9634626 0.86 AURKA (0.67) PRMT5AURKAHPSEFAAHMETAP2
SCHEMBL9636535 0.82 PDE2A (0.62) PRMT5AURKAPDE2A
SCHEMBL9634777 0.82 PDE5A (0.57) PRMT5AURKAPDE2A
SCHEMBL23743183 0.81 NPC1 (0.61)
SCHEMBL10741124 0.81 PRMT5 (0.42) PRMT5AURKAMETAP2METAP1
SCHEMBL11772846 0.79 AURKA (1.00) PRMT5AURKAHPSEMETAP2METAP1
SCHEMBL15972282 0.79 PRMT5 (1.00) PRMT5AURKA
SCHEMBL9634375 0.79 PDE2A (0.75) AURKAPDE2A
SCHEMBL9635006 0.78 AURKA (0.68) PRMT5AURKAHPSEMETAP2METAP1

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
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4616090-A 2-arylimidazopyridines intermediates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-07 US disclosed
EP-0072926-B1 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GmbH (DE) 1986-09-24 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed