SCHEMBL7879919

SCHEMBL7879919

CN(C(=N)N)C(=O)c1cc2c(Cl)ccc(Oc3ccc(CN4CCCCC4)cc3)c2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.41
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7881384 0.99 HRH3 (0.39) HRH3GAAALDH1A1LMNA
SCHEMBL7882269 0.92 KDM4E (0.40) ALDH1A1
SCHEMBL7884748 0.91 CCR8 (0.40) ALDH1A1
SCHEMBL7879862 0.90 HRH3 (0.38) HRH3
SCHEMBL7877795 0.89 DYRK1A (0.35) HRH3
SCHEMBL7882232 0.89 SCN9A (0.38) HRH3
SCHEMBL7873564 0.86 MEN1 (0.41) HRH3ALDH1A1
SCHEMBL7880166 0.86 HTR2A (0.39)
SCHEMBL7877507 0.86 HRH3 (0.39) HRH3
SCHEMBL7884712 0.86 SLC6A4 (0.34) HRH3

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