SCHEMBL7877987

SCHEMBL7877987

CN(C(=N)N)C(=O)c1cc2c(Cl)cc(OCc3cccc(CN)c3)cc2[nH]1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.36
MAOB P27338 4/20 0.36
F2 P00734 5/20 0.36
CFD P00746 1/20 0.36
ALOX5 P09917 1/20 0.35
F10 P00742 1/20 0.35
SRD5A2 P31213 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
FLT3 P36888 1/20 0.34

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
SCHEMBL7881416 0.93 MAOB (0.36) MAOBF2ALOX5F10SRD5A2
Hydrochloric Acid SCHEMBL7879399 0.93 MAOB (0.37) MAOBF2ALOX5F10SRD5A2
SCHEMBL7880955 0.92 MAOB (0.38) MRGPRX4MAOBF2CFDALOX5
Hydrochloric Acid SCHEMBL7881035 0.90 MAOB (0.36) MRGPRX4MAOBF2CFDALOX5
SCHEMBL7884598 0.89 GYS1 (0.37) MRGPRX4MAOBF2CFDF10
SCHEMBL7880851 0.88 PPARG (0.40) F2F10MEN1KMT2ARXFP1
SCHEMBL7879917 0.86 MRGPRX4 (0.37) MRGPRX4MAOBF2CFDSRD5A2
SCHEMBL7882148 0.86 KDM4E (0.38) MAOBF2MEN1KMT2ARXFP1
SCHEMBL7873930 0.85 FFAR1 (0.31) MRGPRX4FLT3
SCHEMBL7873532 0.85 MAP2 (0.38) MAOBF2F10MEN1KMT2A

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