SCHEMBL9635706

SCHEMBL9635706

OCCOc1ccccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 15/20 0.63
PDE10A Q9Y233 2/20 0.48
PDE4A P27815 7/20 0.47
PDE4B Q07343 7/20 0.47
PDE4C Q08493 7/20 0.47
PDE4D Q08499 7/20 0.47
TNF P01375 1/20 0.42
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9635857 0.88 PDE5A (0.71) PDE5APDE10APDE4APDE4BPDE4C
SCHEMBL7271001 0.86 PDE5A (0.61) PDE5APDE10APDE4APDE4BPDE4C
SCHEMBL10416662 0.85 PDE5A (0.57) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635639 0.85 PDE5A (0.62) PDE5APDE10APDE4APDE4BPDE4C
SCHEMBL9634947 0.84 PDE5A (0.46) PDE5APDE10A
SCHEMBL9636138 0.84 PDE5A (0.46) PDE5A
SCHEMBL9634571 0.83 MEN1 (0.59) PDE5APDE10APDE4APDE4BPDE4C
SCHEMBL7279141 0.82 PDE5A (0.57) PDE5APDE10APDE4APDE4BPDE4C
SCHEMBL9635705 0.82 PDE2A (0.47) PDE5A
SCHEMBL9634602 0.81 PDE5A (0.53) PDE5APDE10APDE4APDE4BPDE4C

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