SCHEMBL7878085

SCHEMBL7878085

CN(C)Cc1ccccc1Oc1cccc2cc(C(=O)N(C)C(=N)N)[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.43
SLC6A2 P23975 14/20 0.43
SLC6A3 Q01959 12/20 0.43
HTR2A P28223 4/20 0.37
KCNH2 Q12809 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL7881986 0.91 TP53 (0.36) KDM4E
SCHEMBL7877457 0.88 MEN1 (0.39) KDM4E
SCHEMBL7877942 0.85 SLC6A4 (0.47) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL7873374 0.85 HDAC3 (0.39)
SCHEMBL7880200 0.85 RXFP1 (0.38) SLC6A4SLC6A2HTR2A
SCHEMBL7877961 0.85 MEN1 (0.41) KCNH2KDM4E
Hydrochloric Acid SCHEMBL7878079 0.84 HDAC3 (0.38)
SCHEMBL7873462 0.84 F10 (0.42)
SCHEMBL7877779 0.84 MEN1 (0.43) KCNH2KDM4E
SCHEMBL7878082 0.84 BRD4 (0.39)

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