SCHEMBL7279538

SCHEMBL7279538

CCCOc1cc(OC)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 8/20 0.51
▸ PDE2A O00408 1/20 0.48
▸ GCGR P47871 2/20 0.46
▸ MAPK13 O15264 1/20 0.46
▸ MAPK12 P53778 1/20 0.46
▸ MAPK11 Q15759 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ PDE3B Q13370 1/20 0.44
▸ PDE3A Q14432 1/20 0.44
▸ PDE4A P27815 2/20 0.43
▸ PDE4B Q07343 2/20 0.43
▸ PDE4C Q08493 2/20 0.43
▸ PDE4D Q08499 2/20 0.43
▸ CYP11B1 P15538 2/20 0.43
▸ CYP11B2 P19099 2/20 0.43
▸ ACHE P22303 1/20 0.41
▸ AMY1A P0DUB6 3/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ RUNX1 Q01196 1/20 0.40

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 SCHEMBL10849048 0.99 PDE5A (0.51) PDE5APDE2AGCGRMAPK13MAPK12
SCHEMBL7282319 0.96 PDE5A (0.54) PDE5APDE2AGCGRMAPK13MAPK12
Hydrochloric Acid SCHEMBL7278437 0.93 PDE5A (0.60) PDE5APDE2AGCGRMAPK13MAPK12
SCHEMBL7270741 0.93 PDE5A (0.57) PDE5APDE2AGCGRMAPK13MAPK12
SCHEMBL7271240 0.91 PDE2A (0.48) PDE5APDE2APDE3BPDE3ACYP11B1
SCHEMBL7272286 0.91 PDE2A (0.50) PDE5APDE2APDE3BPDE3ACYP11B1
SCHEMBL10416990 0.90 PDE2A (0.47) PDE5APDE2AGCGRPDE3BPDE3A
SCHEMBL10848217 0.90 PDE2A (0.47) PDE5APDE2AGCGRMAPK13MAPK12
SCHEMBL9635705 0.90 PDE2A (0.47) PDE5APDE2APDE3BPDE3ACYP11B1
SCHEMBL7272325 0.89 PDE2A (0.44) PDE5APDE2AGCGRMAPK13MAPK12

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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