SCHEMBL7879982

SCHEMBL7879982

CNC(N)=NC(=O)c1cc2cccc(OCc3ccc(CN(C)C)s3)c2[nH]1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
IDO1 P14902 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30
FFAR1 O14842 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 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
SCHEMBL7880904 0.90 FLT3 (0.35) FLT3MTNR1AMTNR1BIDO1HRH4
SCHEMBL7879445 0.88 MTNR1A (0.32) FLT3MTNR1AMTNR1BIDO1HRH4
SCHEMBL7880990 0.87 MGMT (0.38) FLT3IDO1HRH4GAA
SCHEMBL7873771 0.86 ALDH1A1 (0.37) FLT3MTNR1AMTNR1BIDO1HRH4
SCHEMBL7881388 0.86 MAPT (0.38) FLT3MTNR1AMTNR1BIDO1HRH4
SCHEMBL7877460 0.85 MEN1 (0.38) FLT3MTNR1AMTNR1BIDO1HRH4
SCHEMBL7877476 0.85 MRGPRX4 (0.35)
SCHEMBL7885052 0.83 MRGPRX4 (0.32)
SCHEMBL7881157 0.81 HTR1B (0.44) MTNR1AMTNR1BDRD2DRD3
SCHEMBL7877709 0.81 FLT3 (0.39) FLT3LMNA

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