SCHEMBL7277622

SCHEMBL7277622

C=CCOc1cc(OC)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.47
PDE5A O76074 4/20 0.44
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
AURKA O14965 2/20 0.40
KDR P35968 2/20 0.40
AMY1A P0DUB6 3/20 0.40
ACHE P22303 1/20 0.40
NPC1 O15118 3/20 0.38
RAB9A P51151 2/20 0.38
RUNX1 Q01196 1/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38
FLT3 P36888 1/20 0.38

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 SCHEMBL10848480 0.99 PDE2A (0.46) PDE2APDE5APDE3BPDE3AAURKA
SCHEMBL9635742 0.92 PDE5A (0.39) PDE2APDE5APDE3BPDE3AALDH1A1
SCHEMBL9635925 0.92 PDE5A (0.47) PDE2APDE5APDE3BPDE3AAURKA
SCHEMBL9634764 0.91 CBFB (0.41) PDE2APDE5APDE3BPDE3ANPC1
SCHEMBL9636088 0.89 CBFB (0.41) PDE2APDE5APDE3BPDE3AALDH1A1
SCHEMBL9635794 0.88 PDE5A (0.40) PDE2APDE5APDE3BPDE3ANPC1
SCHEMBL10739601 0.87 PDE2A (0.46) PDE2APDE5APDE3BPDE3AAMY1A
SCHEMBL7272286 0.87 PDE2A (0.50) PDE2APDE5APDE3BPDE3AAURKA
SCHEMBL9634904 0.87 PDE5A (0.39) PDE2APDE5APDE3BPDE3AALDH1A1
SCHEMBL9635747 0.86 LMNA (0.42) PDE2APDE5APDE3BPDE3ANPC1

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