SCHEMBL7879705

SCHEMBL7879705

CN(C(=N)N)C(=O)c1cc2c(Cl)cc(Oc3ccccc3CN3CCCCC3)cc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CCR8 P51685 3/20 0.36
KCNH2 Q12809 3/20 0.36
SOS1 Q07889 2/20 0.36
HTR3A P46098 2/20 0.36
RHEB Q15382 2/20 0.36
HRH3 Q9Y5N1 1/20 0.35
SCN9A Q15858 2/20 0.34
KDM4E B2RXH2 2/20 0.34
PTPN11 Q06124 1/20 0.34
ALDH1A1 P00352 1/20 0.33
KDR P35968 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
SCHEMBL7884286 0.99 MEN1 (0.38) MEN1KMT2ACCR8KCNH2SOS1
SCHEMBL7877750 0.88 MEN1 (0.38) MEN1KMT2AHTR3ARHEBSCN9A
SCHEMBL7873408 0.87 SCN9A (0.38) MEN1KMT2AHTR3ARHEBSCN9A
SCHEMBL7877811 0.86 HRH3 (0.41) HRH3KDM4EKDR
SCHEMBL7880766 0.86 RHEB (0.40) MEN1KMT2AKCNH2RHEB
SCHEMBL7884263 0.86 KMT2A (0.41) MEN1KMT2ASCN9AKDM4E
SCHEMBL7879668 0.85 HRH3 (0.39) RHEBHRH3KDM4EKDR
SCHEMBL7879998 0.85 SLC6A4 (0.47) KCNH2RHEB
SCHEMBL7881368 0.85 KDM4E (0.39) CCR8KCNH2HTR3AKDM4EALDH1A1
SCHEMBL7873564 0.85 MEN1 (0.41) MEN1KMT2ACCR8KCNH2SOS1

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