SCHEMBL7879950

SCHEMBL7879950

CCN(CC)Cc1ccc(Oc2cc(C(F)(F)F)c3cc(C(=O)N(C)C(=N)N)[nH]c3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
RXFP1 Q9HBX9 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
SCN9A Q15858 3/20 0.32
ACHE P22303 2/20 0.32
AR P10275 3/20 0.31
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 0.31
GRIA4 P48058 1/20 0.31
BRAF P15056 1/20 0.31
CHEK2 O96017 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7881487 0.92 RHEB (0.36) RHEBMEN1KMT2ARXFP1SCN9A
SCHEMBL7877872 0.91 MEN1 (0.34) RHEBMEN1KMT2ARXFP1SCN9A
SCHEMBL7882182 0.90 HRH3 (0.39) RHEBMEN1KMT2ARXFP1HRH3
SCHEMBL7878038 0.90 RHEB (0.32) RHEB
SCHEMBL7873341 0.89 ST14 (0.39) RHEBMEN1KMT2ARXFP1SCN9A
SCHEMBL7879968 0.87 RHEB (0.31) RHEB
SCHEMBL7884253 0.86 RHEB (0.37) RHEBMEN1KMT2ARXFP1HRH3
SCHEMBL7877441 0.86 RHEB (0.39) RHEBSCN9AARBRAFCHEK2
SCHEMBL7878261 0.85 SCN9A (0.37) RHEBMEN1KMT2ASCN9AACHE
SCHEMBL7879507 0.85 RHEB (0.32) RHEBAR

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