SCHEMBL9635841

SCHEMBL9635841

C=CCOc1ccc(-c2nc3cnccc3[nH]2)c(OCC#N)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PDE5A O76074 6/20 0.34
MAOA P21397 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
PDE10A Q9Y233 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TP53 P04637 1/20 0.34
PDE2A O00408 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
FGFR1 P11362 1/20 0.31
GCGR P47871 2/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31

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
SCHEMBL9634902 0.96 PDE5A (0.34) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL9634527 0.91 PDE5A (0.39) SMN1; SMN2PDE5APDE3BPDE3APDE10A
SCHEMBL9635742 0.91 PDE5A (0.39) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL9636158 0.90 PDE5A (0.34) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL10743319 0.88 LMNA (0.37) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL9636094 0.87 CBFB (0.41) LMNASMN1; SMN2PDE5APDE3BPDE3A
SCHEMBL9635794 0.87 PDE5A (0.40) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL9634601 0.86 TOP1 (0.36) LMNASMN1; SMN2NPSR1PDE5AMAOA
SCHEMBL9635731 0.86 TOP1 (0.37) PDE5AMAOAPDE3BPDE3APDE10A
SCHEMBL9634126 0.86 TOP1 (0.37) PDE5AMAOAPDE3BPDE3APDE10A

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-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