SCHEMBL9018708

SCHEMBL9018708

Cc1cc(C)c(C(F)(F)F)cc1C(=O)N=C(N)N

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.57
KCNH2 Q12809 1/20 0.57

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
SCHEMBL7799903 0.90 SLC9A1 (0.57) SLC9A1KCNH2
SCHEMBL8611037 0.90 SLC9A1 (0.50) SLC9A1KCNH2
Hydrochloric Acid SCHEMBL7801201 0.89 SLC9A1 (0.56) SLC9A1KCNH2
SCHEMBL7083108 0.88 SLC9A1 (0.55) SLC9A1KCNH2
SCHEMBL8428729 0.86 SLC9A1 (0.48) SLC9A1KCNH2
SCHEMBL9018710 0.86 SLC9A1 (0.54) SLC9A1KCNH2
SCHEMBL9018681 0.86 SLC9A1 (0.54) SLC9A1KCNH2
Hydrochloric Acid SCHEMBL8337106 0.85 SLC9A1 (0.47) SLC9A1KCNH2
SCHEMBL9018670 0.85 SLC9A1 (0.47) SLC9A1KCNH2
SCHEMBL7802980 0.84 SLC9A1 (0.55) SLC9A1KCNH2

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
EP-0743301-A2 Benzoylguanidines containing fluorine MERCK PATENT GmbH (DE) 1996-11-20 EP claimed
EP-0743301-A2 Benzoylguanidines containing fluorine MERCK PATENT GmbH (DE) 1996-11-20 EP disclosed