SCHEMBL7272286

SCHEMBL7272286

CCOc1cc(OC)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.50
PDE5A O76074 6/20 0.47
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
ACHE P22303 1/20 0.43
AMY1A P0DUB6 3/20 0.43
CTSG P08311 1/20 0.42
KLK7 P49862 1/20 0.42
KLK14 Q9P0G3 1/20 0.42
KLK5 Q9Y337 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
RUNX1 Q01196 1/20 0.41
AURKA O14965 1/20 0.41
KDR P35968 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 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
SCHEMBL7279872 0.93 CBFB (0.46) PDE2APDE5APDE3BPDE3ANPC1
SCHEMBL7279538 0.91 PDE5A (0.51) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL7282319 0.91 PDE5A (0.54) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL7281375 0.91 PDE5A (0.51) PDE2APDE5APDE3BPDE3AAMY1A
Hydrochloric Acid SCHEMBL10849048 0.90 PDE5A (0.51) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL7270959 0.89 PDE2A (0.58) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL7271240 0.89 PDE2A (0.48) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL7270741 0.88 PDE5A (0.57) PDE2APDE5APDE3BPDE3AACHE
Hydrochloric Acid SCHEMBL7278437 0.88 PDE5A (0.60) PDE2APDE5APDE3BPDE3AACHE
Hydrochloric Acid SCHEMBL7272531 0.88 PDE2A (0.57) PDE2APDE5APDE3BPDE3AACHE

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 7 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-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-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-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