SCHEMBL9634908

SCHEMBL9634908

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

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.65
AURKA O14965 5/20 0.65
PARP1 P09874 1/20 0.60
CYP1A1 P04798 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP1B1 Q16678 1/20 0.53
HPSE Q9Y251 1/20 0.51
FAAH O00519 1/20 0.48
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47

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
SCHEMBL9635700 0.87 PRMT5 (0.65) PRMT5AURKAHPSEFAAHMETAP2
SCHEMBL9635915 0.86 AURKA (0.67) PRMT5AURKAPARP1FAAHMETAP2
SCHEMBL9635006 0.84 AURKA (0.68) PRMT5AURKAHPSEMETAP2METAP1
SCHEMBL9634492 0.83 AURKA (0.63) PRMT5AURKAPARP1CYP1A2
SCHEMBL9635813 0.83 AURKA (0.54) PRMT5AURKAPARP1METAP2METAP1
SCHEMBL9635685 0.82 PDE5A (0.57) PRMT5AURKAPARP1
SCHEMBL9634394 0.82 PDE2A (0.62) PRMT5AURKACYP1A2
SCHEMBL10061954 0.81 CYP1A1 (0.69) PARP1CYP1A1CYP1A2CYP1B1
SCHEMBL10739608 0.81 CYP1A1 (0.52) PRMT5AURKAPARP1CYP1A1CYP1A2
SCHEMBL9634352 0.81 AURKA (0.48) PRMT5AURKAPARP1HPSEFAAH

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