SCHEMBL9636034

SCHEMBL9636034

COC(=O)COc1ccccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 12/20 0.54
KDM4E B2RXH2 1/20 0.51
USP2 O75604 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
PDE10A Q9Y233 1/20 0.42
GUSB P08236 1/20 0.41
AURKA O14965 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
AMY1A P0DUB6 1/20 0.40

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
SCHEMBL9634575 0.89 PDE5A (0.53) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL9634571 0.87 MEN1 (0.59) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL9636021 0.86 PDE5A (0.42) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL9635076 0.83 PDE5A (0.48) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL9635639 0.82 PDE5A (0.62) PDE5AKDM4EUSP2ALDH1A1HPGD
SCHEMBL7271001 0.81 PDE5A (0.61) PDE5APDE10AAURKAPDE4APDE4B
SCHEMBL9636149 0.81 PDE5A (0.40) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL10851751 0.81 PDE5A (0.80) PDE5AKDM4EALDH1A1HPGDAURKA
SCHEMBL9635749 0.81 LPAR2 (0.43) PDE5AKDM4EUSP2ALDH1A1GAA
SCHEMBL9636063 0.80 PDE5A (0.38) PDE5AKDM4EUSP2ALDH1A1GAA

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