SCHEMBL6965047

SCHEMBL6965047

Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccc(OC(=O)C=Cc4ccccc4)cc3C2C)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
BCHE P06276 2/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
KCNH3 Q9ULD8 1/20 0.33
EGFR P00533 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
DRD2 P14416 3/20 0.32
DRD3 P35462 3/20 0.32
F3 P13726 1/20 0.32
NFE2L2 Q16236 1/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL6965565 1.00 KMT2A (0.35) KMT2AMEN1KDM4EGAABCHE
SCHEMBL6957433 0.94 KMT2A (0.36) KMT2AMEN1KDM4EGAABCHE
SCHEMBL6957425 0.94 KMT2A (0.36) KMT2AMEN1KDM4EGAABCHE
SCHEMBL6969924 0.90 KMT2A (0.35) KMT2AMEN1KCNH3EGFRNFE2L2
SCHEMBL6969919 0.90 KMT2A (0.35) KMT2AMEN1KCNH3EGFRNFE2L2
SCHEMBL6970019 0.88 SMN1; SMN2 (0.37) KMT2AMEN1KDM4EKCNH3EGFR
SCHEMBL6966508 0.87 KMT2A (0.37) KMT2AMEN1KCNH3EGFRNFE2L2
SCHEMBL6961880 0.85 KMT2A (0.38) KMT2AMEN1KDM4EEGFRMAPT
SCHEMBL6963615 0.85 KMT2A (0.35) KMT2AMEN1KDM4EEGFRNFE2L2
SCHEMBL6957217 0.85 KMT2A (0.35) KMT2AMEN1KCNH3EGFRNFE2L2

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
EP-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP claimed
EP-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed