SCHEMBL9634585

SCHEMBL9634585

CCCSc1ccccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 7/20 0.61
KDM4E B2RXH2 8/20 0.45
ALDH1A1 P00352 7/20 0.45
NPC1 O15118 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 3/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
LDHA P00338 1/20 0.38
EPHX2 P34913 1/20 0.38
TP53 P04637 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
PKN1 Q16512 1/20 0.38
PKN2 Q16513 1/20 0.38

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
SCHEMBL9635775 0.90 KDM4E (0.53) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9635663 0.88 PDE5A (0.46) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL10734538 0.85 PDE5A (0.60) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9636041 0.84 MEN1 (0.45) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL7270979 0.83 ALOX5 (0.51) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL10845977 0.82 PDE5A (0.50) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9635919 0.81 KDM4E (0.42) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9635740 0.81 KDM4E (0.56) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9634681 0.81 KMT2A (0.46) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL9635651 0.80 ALDH1A1 (0.53) PDE5AKDM4EALDH1A1NPC1SMN1; SMN2

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