SCHEMBL9635802

SCHEMBL9635802

COc1csc(C)c1-c1nc2cnccc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.46
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
AMY1A P0DUB6 5/20 0.38
METAP1 P53582 1/20 0.36
PKN1 Q16512 1/20 0.36
PKN2 Q16513 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX5 P09917 1/20 0.35
EPHX2 P34913 1/20 0.35
AURKA O14965 1/20 0.35
KDR P35968 1/20 0.35
FGFR1 P11362 2/20 0.34
FLT1 P17948 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9636245 0.86 KDM4C (0.39) PDE5AKDM4EALDH1A1HPGDMETAP1
SCHEMBL9634651 0.85 METAP1 (0.39) PDE5AKDM4EALDH1A1HPGDMETAP1
SCHEMBL9636067 0.83 FGFR1 (0.40) PDE5AKDM4EALDH1A1HPGDMETAP1
SCHEMBL10742025 0.82 PDE5A (0.37) PDE5AKDM4EALDH1A1HPGDPDE3B
SCHEMBL9634542 0.82 PDE10A (0.39) PDE5AKDM4EALDH1A1HPGDMETAP1
SCHEMBL9636529 0.82 METAP1 (0.34) PDE5AKDM4EALDH1A1HPGDMETAP1
SCHEMBL7271878 0.81 PDE5A (0.57) PDE5AKDM4EALDH1A1HPGDPDE3B
SCHEMBL9634600 0.81 PDE5A (0.40) PDE5AKDM4EALDH1A1HPGDPDE3B
Hydrochloric Acid SCHEMBL7278102 0.80 PDE5A (0.58) PDE5AKDM4EALDH1A1HPGDPDE3B
Hydrochloric Acid SCHEMBL9838295 0.80 PDE5A (0.41) PDE5AKDM4EALDH1A1HPGDPDE3B

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