SCHEMBL9636054

SCHEMBL9636054

CSc1cc(O)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.48
CCNA2 P20248 2/20 0.48
CCND1 P24385 2/20 0.48
CDK2 P24941 2/20 0.48
CCND3 P30281 2/20 0.48
FGFR1 P11362 1/20 0.48
AMY1A P0DUB6 2/20 0.41
KDM4E B2RXH2 3/20 0.38
GAA P10253 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MGAM O43451 2/20 0.38
SI P14410 2/20 0.38
MGAM2 Q2M2H8 2/20 0.38
PDE5A O76074 3/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
CHEK1 O14757 1/20 0.36
PRKD3 O94806 1/20 0.36
PAK4 O96013 1/20 0.36
PDGFRA P16234 1/20 0.36

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
SCHEMBL7272073 0.86 KDM4E (0.39) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL10734983 0.84 CDK4 (0.47) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL7281864 0.84 AMY1A (0.57) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL9635793 0.82 ACHE (0.45) AMY1AKDM4EPDE5APDE3BPDE3A
SCHEMBL7270979 0.81 ALOX5 (0.51) CDK2KDM4EGAANPSR1PDE5A
SCHEMBL9636036 0.81 AMY1A (0.39) AMY1AKDM4EGAANPSR1MGAM
Hydrochloric Acid SCHEMBL10845977 0.80 PDE5A (0.50) CDK2KDM4EGAANPSR1PDE5A
SCHEMBL9636239 0.80 CBFB (0.44) KDM4ENPSR1PDE5APDE3BPDE3A
SCHEMBL7282149 0.80 CDK4 (0.56) CDK4CCNA2CCND1CDK2CCND3
Hydrochloric Acid SCHEMBL10847852 0.80 PDE5A (0.39) AMY1AKDM4EGAANPSR1MGAM

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