SCHEMBL7878261

SCHEMBL7878261

CCN(CC)Cc1ccccc1Oc1cc(C(F)(F)F)c2cc(C(=O)N(C)C(=N)N)[nH]c2c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 8/20 0.37
AR P10275 2/20 0.36
RHEB Q15382 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ACHE P22303 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
SLC1A5 Q15758 3/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL7878193 0.92 SLC6A4 (0.41) SCN9AARRHEBSLC6A2SLC6A4
SCHEMBL7884854 0.90 RHEB (0.37) SCN9AARRHEBMEN1KMT2A
SCHEMBL7881845 0.88 MAOB (0.36) SCN9AARRHEBMEN1KMT2A
SCHEMBL7877568 0.87 SLC6A4 (0.39) SCN9ARHEBMEN1KMT2ASLC6A2
SCHEMBL7879950 0.85 RHEB (0.35) SCN9AARRHEBMEN1KMT2A
SCHEMBL7878216 0.85 RHEB (0.39) ARRHEBMEN1KMT2A
SCHEMBL7877872 0.85 MEN1 (0.34) SCN9ARHEBMEN1KMT2A
SCHEMBL7882054 0.85 SCN9A (0.37) SCN9AMEN1KMT2AACHESLC6A2
SCHEMBL7873408 0.85 SCN9A (0.38) SCN9ARHEBMEN1KMT2ALMNA
SCHEMBL7877750 0.84 MEN1 (0.38) SCN9ARHEBMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248772-B1 HYPOTENSIVE AGENTS; ANTIARRHYTHMIA AGENTS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2001-06-19 US disclosed
US-6169107-B1 USEFUL FOR THE TREATMENT AND PREVENTION OF DISEASES CAUSED BY INCREASED SODIUM/PROTON (NA.SUP.+ /H.SUP.+) EXCHANGER ACTIVITY, FOR EXAMPLE, HYPERTENSION, ARRHYTHMIA, ANGINA PECTORIS, CARDIAC HYPERTROPHY, DIABETES MELLITUS SUMITOMO PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed