SCHEMBL6957649

SCHEMBL6957649

Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccc(OC(=O)C4CCC4)cc3C2C)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MARK3 P27448 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
HTR1A P08908 1/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
HTR1F P30939 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
EGFR P00533 1/20 0.34
FYN P06241 1/20 0.34
PDGFRB P09619 1/20 0.34
FGFR1 P11362 1/20 0.34
PDGFRA P16234 1/20 0.34
PRKACA P17612 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34
PRKACG P22612 1/20 0.34
PRKACB P22694 1/20 0.34

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
SCHEMBL6966924 0.98 KMT2A (0.34) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6960905 0.97 KMT2A (0.35) KMT2AMARK3SMN1; SMN2HTR1AHTR1D
SCHEMBL6969827 0.94 KMT2A (0.35) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6961488 0.92 KMT2A (0.34) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6958624 0.91 KMT2A (0.35) KMT2AMARK3SMN1; SMN2HTR1AHTR1D
SCHEMBL6966508 0.90 KMT2A (0.37) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6957217 0.87 KMT2A (0.35) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6963615 0.87 KMT2A (0.35) KMT2AMARK3SMN1; SMN2HTR1AHTR1D
SCHEMBL6969919 0.87 KMT2A (0.35) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6969924 0.87 KMT2A (0.35) KMT2AMARK3L3MBTL1SMN1; SMN2HTR1A

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 4 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 disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed
EP-1015444-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION, LTD. (KR) 2000-07-05 EP disclosed
WO-1998043968-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1998-10-08 WO disclosed