SCHEMBL7882153

SCHEMBL7882153

CN(C(=N)N)C(=O)c1cc2c(C(F)(F)F)cc(Oc3ccccn3)cc2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.35
BTK Q06187 1/20 0.35
RHEB Q15382 2/20 0.34
BRS3 P32247 1/20 0.33
DHODH Q02127 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NTRK1 P04629 1/20 0.33
MAPK8 P45983 4/20 0.32
MAPK10 P53779 4/20 0.32
PTGS2 P35354 1/20 0.32
AR P10275 2/20 0.31
SYK P43405 2/20 0.31
F10 P00742 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
SCHEMBL7873651 0.89 RHEB (0.34) RHEBMAPK8MAPK10AR
SCHEMBL7881897 0.87 RHEB (0.40) RHEB
SCHEMBL7884557 0.86 LOXL2 (0.40)
SCHEMBL7877762 0.86 DHODH (0.36) BTKRHEBDHODHKDM4EPTGS2
SCHEMBL7881230 0.85 RHEB (0.32) RHEBMAPK8
SCHEMBL7873735 0.85 RHEB (0.36) RHEBAR
SCHEMBL7879746 0.85 RHEB (0.32) RHEB
SCHEMBL7881132 0.84 RHEB (0.36) RHEB
SCHEMBL7880736 0.84 SMN1; SMN2 (0.39) BTKRHEBBRS3
SCHEMBL7878216 0.83 RHEB (0.39) 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