SCHEMBL9181753

SCHEMBL9181753

CS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1N1CCC(N2CCCC2)CC1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.79

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
SCHEMBL9181367 0.99 SLC9A1 (0.81) SLC9A1
Hydrochloric Acid SCHEMBL9183095 0.99 SLC9A1 (0.78) SLC9A1
Hydrochloric Acid SCHEMBL9177616 0.98 SLC9A1 (0.80) SLC9A1
SCHEMBL3906519 0.89 SLC9A1 (1.00) SLC9A1
SCHEMBL29357040 0.89 SLC9A1 (1.00) SLC9A1
SCHEMBL7823707 0.88 SLC9A1 (0.77) SLC9A1
Hydrochloric Acid SCHEMBL9436783 0.88 SLC9A1 (0.98) SLC9A1
Hydrochloric Acid SCHEMBL9436769 0.88 SLC9A1 (0.98) SLC9A1
Hydrochloric Acid SCHEMBL7834575 0.87 SLC9A1 (0.75) SLC9A1
Hydrochloric Acid SCHEMBL7835799 0.87 SLC9A1 (0.75) SLC9A1

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-5461066-A 4-amino-1-piperidylbenzoylguanidines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-10-24 US disclosed
EP-0667341-A1 4-Amino-1-piperidylbenzoylguanidines as Na+/H+ antiporter inhibitors MERCK PATENT GmbH (DE) 1995-08-16 EP disclosed