SCHEMBL6935472

SCHEMBL6935472

Cc1cc(Sc2ccccc2Cl)c(S(C)(=O)=O)cc1C(=O)N=C(N)N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.60

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
SCHEMBL6938541 0.90 SLC9A1 (0.64) SLC9A1
SCHEMBL6936965 0.87
SCHEMBL7798517 0.87 SLC9A1 (0.60) SLC9A1
SCHEMBL6933370 0.87 SLC9A1 (0.60) SLC9A1
SCHEMBL7798363 0.85 SLC9A1 (0.64) SLC9A1
SCHEMBL9192614 0.84 SLC9A1 (0.53) SLC9A1
SCHEMBL6935220 0.84 SLC9A1 (0.56) SLC9A1
SCHEMBL8925101 0.83 ALDH1A1 (0.37)
SCHEMBL6937449 0.83 SLC9A1 (0.61) SLC9A1
Hydrochloric Acid SCHEMBL8816000 0.83 SLC9A1 (0.52) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758644-B1 Sulfonyl- or sulfinyl-benzoyl-guanidine derivatives MERCK PATENT GMBH (DE) 2003-10-15 EP disclosed
EP-0725062-B1 4-mercapto-benzoylguanidine derivatives MERCK PATENT GMBH (DE) 2001-06-13 EP disclosed
US-5744641-A Sulfonyl- or sulfinylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-28 US disclosed
US-5696167-A 4-mercaptobenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-12-09 US disclosed
EP-0758644-A1 Sulfonyl- or sulfinyl-benzoyl-guanidine derivatives MERCK PATENT GmbH (DE) 1997-02-19 EP disclosed
EP-0725062-A1 4-mercapto-benzoylguanidine derivatives MERCK PATENT GmbH (DE) 1996-08-07 EP disclosed