SCHEMBL7873402

SCHEMBL7873402

CN(C(=N)N)C(=O)c1cc2c(C(F)(F)F)cc(Oc3ccnc([N+](=O)[O-])c3)cc2[nH]1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.34
KDR P35968 2/20 0.33
RAF1 P04049 5/20 0.33
BRAF P15056 3/20 0.33
CHEK2 O96017 1/20 0.31

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
SCHEMBL7878080 0.87 RHEB (0.31) RHEBCHEK2
SCHEMBL7881132 0.87 RHEB (0.36) RHEBKDRRAF1BRAFCHEK2
SCHEMBL7879746 0.86 RHEB (0.32) RHEB
SCHEMBL7884282 0.85 MEN1 (0.39) RHEBCHEK2
SCHEMBL7882205 0.85 BRAF (0.35) RHEBKDRRAF1BRAF
SCHEMBL7873735 0.85 RHEB (0.36) RHEBKDRRAF1BRAFCHEK2
SCHEMBL7881113 0.85 F10 (0.38) RHEB
SCHEMBL7877800 0.84 KDR (0.35) RHEBKDRRAF1BRAF
SCHEMBL7873782 0.83 MEN1 (0.38) RAF1BRAFCHEK2
SCHEMBL7873257 0.83 ALDH1A1 (0.34) RHEB

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