SCHEMBL7884263

SCHEMBL7884263

CN(C(=N)N)C(=O)c1cc2ccc(Oc3ccccc3CN3CCCCC3)cc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.41
MEN1 O00255 6/20 0.41
RXFP1 Q9HBX9 3/20 0.41
FLT3 P36888 1/20 0.40
SCN9A Q15858 3/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
NPC1 O15118 4/20 0.37
RAB9A P51151 3/20 0.37
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL7873680 0.99 KMT2A (0.42) KMT2AMEN1RXFP1FLT3SCN9A
SCHEMBL7879877 0.86 FLT3 (0.42) KMT2AMEN1RXFP1FLT3NPC1
SCHEMBL7879705 0.86 MEN1 (0.40) KMT2AMEN1SCN9AKDM4E
SCHEMBL7877857 0.85 MEN1 (0.47) KMT2AMEN1RXFP1FLT3PDGFRB
SCHEMBL7881076 0.85 RXFP1 (0.44) KMT2AMEN1RXFP1FLT3KDM4E
SCHEMBL7880873 0.85 RXFP1 (0.43) KMT2AMEN1RXFP1FLT3NPC1
SCHEMBL7884286 0.85 MEN1 (0.38) KMT2AMEN1SCN9AKDM4E
SCHEMBL7881957 0.85 MEN1 (0.48) KMT2AMEN1RXFP1FLT3PDGFRB
SCHEMBL7877779 0.84 MEN1 (0.43) KMT2AMEN1SCN9AKDM4E
SCHEMBL7881140 0.84 RXFP1 (0.45) KMT2AMEN1RXFP1FLT3KDM4E

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