SCHEMBL7282149

SCHEMBL7282149

COc1cc(O)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 5/20 0.56
CCNA2 P20248 5/20 0.56
CCND1 P24385 5/20 0.56
CDK2 P24941 5/20 0.56
CCND3 P30281 5/20 0.56
PDE5A O76074 3/20 0.55
PDE3B Q13370 1/20 0.55
PDE3A Q14432 1/20 0.55
CHEK1 O14757 1/20 0.48
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
TYK2 P29597 1/20 0.48
KDR P35968 1/20 0.48
JAK3 P52333 1/20 0.48
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
PDE2A O00408 1/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43

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
SCHEMBL9635782 0.86 PDE5A (0.44) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL7270959 0.86 PDE2A (0.58) PDE5APDE3BPDE3AKDRKDM4E
SCHEMBL7270925 0.86 PDE5A (0.56) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL9634329 0.85 PDE5A (0.55) CDK4CCNA2CCND1CDK2CCND3
Hydrochloric Acid SCHEMBL7272531 0.85 PDE2A (0.57) PDE5APDE3BPDE3AKDRKDM4E
SCHEMBL10415615 0.85 PDE5A (0.57) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL10762876 0.85 PDE5A (0.55) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL7270233 0.85 PDE5A (0.55) PDE5APDE3BPDE3AKDM4EALDH1A1
SCHEMBL10675183 0.84 PDE5A (0.51) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL7272579 0.84 PDE5A (0.56) CDK4CCNA2CCND1CDK2CCND3

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0155094-A1 2-Arylimidazo(4,5-c)pyridines ELI LILLY AND COMPANY (US) 1985-09-18 EP claimed
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4904785-A INOTROPIC AGENTS FOR CARDIOVASCULAR DISORDERS ELI LILLY AND COMPANY (US) 1990-02-27 US disclosed
US-4758574-A 2-phenylimidazio (4,5-c) pyridines ELI LILLY AND COMPANY (US) 1988-07-19 US disclosed
US-4696931-A CARDIOVASCULAR DISORDERS, CARDIOTONIC AGENTS DR. KARL THOMAE GMBH (DE) 1987-09-29 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
US-4582837-A Imidazo[4,5-b] and [4,5-c]pyridine derivatives having cardiotonic activity DR. KARL THOMAE GMBH (DE) 1986-04-15 US disclosed
EP-0155094-A1 2-Arylimidazo(4,5-c)pyridines ELI LILLY AND COMPANY (US) 1985-09-18 EP disclosed
EP-0098448-A2 Imidazole derivatives, their preparation and medicines containing these compounds Dr. Karl Thomae GmbH (DE) 1984-01-18 EP disclosed
EP-0093593-A2 Pyridine compounds ELI LILLY AND COMPANY (US) 1983-11-09 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed