SCHEMBL7281035

SCHEMBL7281035

COc1ccc(OC)c(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 3/20 0.55
▸ KDM4E B2RXH2 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ ACHE P22303 1/20 0.48
▸ PDE3B Q13370 1/20 0.47
▸ PDE3A Q14432 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ PDE2A O00408 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ AMY1A P0DUB6 5/20 0.45
▸ AURKA O14965 1/20 0.44
▸ KDR P35968 1/20 0.44

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
Hydrochloric Acid SCHEMBL7272791 0.99 PDE5A (0.56) PDE5AKDM4EALDH1A1HPGDACHE
Hydrochloric Acid SCHEMBL10844959 0.99 PDE5A (0.56) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL7270959 0.90 PDE2A (0.58) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL10961392 0.89 PDE5A (0.49) PDE5AKDM4EALDH1A1HPGDACHE
Hydrochloric Acid SCHEMBL7272531 0.88 PDE2A (0.57) PDE5AKDM4EALDH1A1HPGDACHE
Hydrochloric Acid SCHEMBL10963211 0.88 PDE5A (0.50) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL9636101 0.85 PDE5A (0.46) PDE5AKDM4EALDH1A1HPGDPDE3B
SCHEMBL9634342 0.85 PDE5A (0.41) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL7272579 0.85 PDE5A (0.56) PDE5AKDM4EALDH1A1HPGDPDE3B
SCHEMBL10845314 0.84 AMY1A (0.53) PDE5AACHEPDE3BPDE3AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4603139-A 2-PHENYL-1H-IMIDAZOL(4,5-C)PYRIDINES, ANTICXOAGULANTS, CARDIOVASCULAR DISORDERS BURROUGHS WELLCOME CO. 1986-07-29 — — US disclosed
EP-0093593-A2 Pyridine compounds ELI LILLY AND COMPANY (US) 1983-11-09 — — EP disclosed
EP-0079083-A1 New imidazo[4,5-c]pyridine derivatives, processes for their preparation and pharmaceutical formulations containing such compounds MERCK PATENT GmbH (DE) 1983-05-18 — — EP disclosed
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