SCHEMBL7879978

SCHEMBL7879978

CN(C)Cc1ccc(COc2cccc3cc(C(=O)N(C)C(=N)N)[nH]c23)s1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.35
AR P10275 3/20 0.34
MAPT P10636 4/20 0.34
TP53 P04637 4/20 0.34
HRH4 Q9H3N8 2/20 0.33
IDO1 P14902 1/20 0.33
LMNA P02545 2/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
FFAR1 O14842 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.30
THRB P10828 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
SCHEMBL7880892 0.91 FLT3 (0.35) FLT3ARMAPTTP53HRH4
SCHEMBL7879444 0.87 AR (0.34) FLT3ARMAPTTP53HRH4
SCHEMBL7880985 0.87 MGMT (0.42) FLT3MAPTTP53HRH4IDO1
SCHEMBL7873765 0.85 MAPT (0.37) FLT3MAPTTP53HRH4IDO1
SCHEMBL7881382 0.85 AR (0.40) FLT3ARMAPTTP53HRH4
SCHEMBL7877457 0.85 MEN1 (0.39) FLT3MAPTTP53HRH4IDO1
SCHEMBL7877467 0.84 MRGPRX4 (0.37)
SCHEMBL7885040 0.82 NEK2 (0.33)
SCHEMBL7877636 0.82 CFD (0.43) FLT3MAPTTP53HRH4IDO1
SCHEMBL7873718 0.81 CFD (0.38) FLT3MAPTTP53HRH4IDO1

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