SCHEMBL7877591

SCHEMBL7877591

CNC(N)=NC(=O)c1cc2c(C(F)(F)F)cc(Oc3cncc(N)c3)cc2[nH]1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 1/20 0.33
RHEB Q15382 1/20 0.33
AR P10275 1/20 0.31
ICAM1 P05362 1/20 0.30
SELE P16581 1/20 0.30
CHEK2 O96017 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
SCHEMBL7884321 0.88 RAF1 (0.35) RAF1RHEBICAM1SELE
SCHEMBL7873260 0.87 SIRT2 (0.34) RAF1RHEBICAM1SELE
SCHEMBL7880782 0.87 RHEB (0.32) RAF1RHEBCHEK2
SCHEMBL7877449 0.86 RHEB (0.39) RAF1RHEBARCHEK2
SCHEMBL7880742 0.86 SMN1; SMN2 (0.40) RHEBCHEK2
SCHEMBL7884770 0.86 RAF1 (0.34) RAF1RHEB
SCHEMBL7882100 0.86 RHEB (0.38) RAF1RHEBARCHEK2
SCHEMBL7873739 0.85 RHEB (0.37) RAF1RHEBARICAM1SELE
SCHEMBL7878042 0.84 RAF1 (0.33) RAF1RHEB
SCHEMBL7881901 0.83 RHEB (0.41) RAF1RHEBCHEK2

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