SCHEMBL14276737

SCHEMBL14276737

Cc1[nH]cnc1C1CCN(c2ncncc2-c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 18/20 0.78
▸ RPS6KB1 P23443 2/20 0.57
▸ AKT1 P31749 1/20 0.53
▸ SLC9A2 Q9UBY0 1/20 0.50

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
SCHEMBL14276734 0.88 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL14276900 0.87 SLC9A1 (0.58) SLC9A1SLC9A2
SCHEMBL14276819 0.86 SLC9A1 (0.80) SLC9A1RPS6KB1SLC9A2
SCHEMBL14276812 0.86 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL14276742 0.85 SLC9A1 (1.00) SLC9A1RPS6KB1SLC9A2
SCHEMBL14276834 0.85 SLC9A1 (0.71) SLC9A1RPS6KB1SLC9A2
SCHEMBL14276738 0.84 SLC9A1 (1.00) SLC9A1RPS6KB1SLC9A2
SCHEMBL14276817 0.83 SLC9A1 (0.78) SLC9A1SLC9A2
SCHEMBL14276818 0.83 SLC9A1 (0.78) SLC9A1SLC9A2
SCHEMBL14276735 0.83 SLC9A1 (0.83) 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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