SCHEMBL7884286

SCHEMBL7884286

CN(C(=N)N)C(=O)c1cc2c(Cl)cc(Oc3ccccc3CN3CCCC3)cc2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CCR8 P51685 3/20 0.37
KCNH2 Q12809 3/20 0.37
RHEB Q15382 2/20 0.36
SOS1 Q07889 2/20 0.35
SCN9A Q15858 1/20 0.35
HTR3A P46098 2/20 0.35
PTPN11 Q06124 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
TACR2 P21452 1/20 0.33
TACR1 P25103 1/20 0.33
TACR3 P29371 1/20 0.33

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
SCHEMBL7879705 0.99 MEN1 (0.40) MEN1KMT2ACCR8KCNH2RHEB
SCHEMBL7873408 0.88 SCN9A (0.38) MEN1KMT2ARHEBSCN9AHTR3A
SCHEMBL7877750 0.87 MEN1 (0.38) MEN1KMT2ARHEBSCN9AHTR3A
SCHEMBL7880766 0.87 RHEB (0.40) MEN1KMT2AKCNH2RHEB
SCHEMBL7879668 0.86 HRH3 (0.39) RHEBHRH3KDM4EDRD2DRD3
SCHEMBL7879998 0.86 SLC6A4 (0.47) KCNH2RHEB
SCHEMBL7873680 0.85 KMT2A (0.42) MEN1KMT2ASCN9ADRD2DRD3
SCHEMBL7877811 0.85 HRH3 (0.41) HRH3KDM4E
SCHEMBL7884245 0.85 FAAH (0.40) CCR8KCNH2KDM4EALDH1A1
SCHEMBL7884263 0.85 KMT2A (0.41) MEN1KMT2ASCN9AKDM4E

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