SCHEMBL8139218

SCHEMBL8139218

O=c1[nH]ccn1C(c1ccccc1)c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ OPRM1 P35372 1/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ OPRL1 P41146 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ CHRM2 P08172 1/20 0.38
▸ SCN1A P35498 1/20 0.38
▸ SCN2A Q99250 1/20 0.38
▸ SCN3A Q9NY46 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ MET P08581 2/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.37
▸ GAA P10253 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KDM4E B2RXH2 3/20 0.35
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL27362709 0.83 GAA (0.47) METNPSR1GAAMEN1KMT2A
SCHEMBL27993778 0.70 MET (0.49) ALDH1A1CYP1A2METMEN1KMT2A
SCHEMBL27784194 0.70 MET (0.49) ALDH1A1CYP1A2METMEN1KMT2A
SCHEMBL9823429 0.69 ALDH1A1 (0.58) SLC6A2SLC6A4SLC6A3OPRM1OPRD1
SCHEMBL9823499 0.67 OPRK1 (0.40) SLC6A2SLC6A4SLC6A3OPRM1OPRD1
SCHEMBL9664748 0.67 CYP19A1 (0.72) SLC6A2SLC6A4SLC6A3OPRM1OPRD1
SCHEMBL3629431 0.67 CYP17A1 (0.36) ALDH1A1METGAAMEN1KMT2A
Piconol SCHEMBL16239700 0.66 PTPRA (0.38) ALDH1A1CYP1A2NPSR1GAAMEN1
SCHEMBL8694125 0.66 MEN1 (0.67) SLC6A2SLC6A4SLC6A3OPRM1OPRD1
SCHEMBL9823778 0.65 ALDH1A1 (0.43) SLC6A2SLC6A4SLC6A3OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664802-B1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 2000-03-15 — — EP disclosed
EP-0508393-B1 N-arylheteroarylalkyl imidazol-2-one compounds for treatment of circulatory disorders SEARLE & CO (US) 1999-06-02 — — EP disclosed
EP-0579766-B1 N-ARYLHETEROARYLALKYL IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 1999-06-02 — — EP disclosed
US-5861420-A ANGIOTENSIN II ANTAGONISTS G. D. SEARLE & CO. (US) 1999-01-19 — — US disclosed
US-5441970-A Administering angiotensin II antagonists to treat congestive heart failure or hypertension G. D. SEARLE & CO. (US) 1995-08-15 — — US disclosed
EP-0508393-A1 N-arylheteroarylalkyl imidazol-2-one compounds for treatment of circulatory disorders G.D. Searle & Co. (US) 1992-10-14 — — EP disclosed
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