SCHEMBL7873655

SCHEMBL7873655

CCN(CC)Cc1cc(Oc2ccc(Cl)c3cc(C(=O)N=C(N)NC)[nH]c23)ccn1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.32
BRAF P15056 6/20 0.32
KDM4E B2RXH2 1/20 0.32
GCK P35557 1/20 0.31
HTR2A P28223 2/20 0.31
SLC6A4 P31645 2/20 0.31
KCNH2 Q12809 1/20 0.31
SCN9A Q15858 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL7877840 0.92 SLC6A4 (0.36) KDRBRAFGCKHTR2ASLC6A4
SCHEMBL7880172 0.86 TP53 (0.35) KDRBRAFGCKSCN9A
SCHEMBL7877759 0.85 SLC6A4 (0.36) HTR2ASLC6A4KCNH2SCN9APKM
SCHEMBL7879890 0.85 CLK1 (0.32) KDM4EPKM
SCHEMBL7877615 0.85 PPARG (0.34) BRAFHTR2ASLC6A4KCNH2SCN9A
SCHEMBL7881176 0.84 MAPK14 (0.38) KDRBRAFGCKHTR2ASLC6A4
SCHEMBL7882132 0.84 KDR (0.32) KDRBRAF
SCHEMBL7884720 0.84 KDR (0.35) KDRSLC6A4SCN9A
SCHEMBL7881417 0.84 DYRK1A (0.33) BRAFGCKHTR2ASLC6A4KCNH2
SCHEMBL7873652 0.83 HTR2A (0.33) BRAFKDM4EHTR2ASLC6A4

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