SCHEMBL14276830

SCHEMBL14276830

COc1ncc(-c2ccc(Cl)cc2)c(N2CCC(c3nc[nH]c3C)CC2)n1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 20/20 0.80
▸ SLC9A2 Q9UBY0 1/20 0.76

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
SCHEMBL14276843 0.89 SLC9A1 (0.77) SLC9A1SLC9A2
SCHEMBL14276835 0.89 SLC9A1 (0.85) SLC9A1SLC9A2
SCHEMBL14276752 0.89 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL14276832 0.89 SLC9A1 (0.77) SLC9A1SLC9A2
SCHEMBL14276833 0.87 SLC9A1 (0.73) SLC9A1SLC9A2
SCHEMBL14276840 0.87 SLC9A1 (0.70) SLC9A1SLC9A2
SCHEMBL30772134 0.87 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL14276839 0.87 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL14276829 0.85 SLC9A1 (0.71) SLC9A1SLC9A2
SCHEMBL14276838 0.84 SLC9A1 (0.74) SLC9A1SLC9A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326705-B2 Heterocyclic sodium/proton exchange inhibitors and method BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-05 — — US disclosed
US-7326705-B2 Heterocyclic sodium/proton exchange inhibitors and method BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-05 — — US disclosed
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