SCHEMBL6960905

SCHEMBL6960905

Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccc(OC(=O)C4CC4)cc3C2C)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
MARK3 P27448 1/20 0.35
HTR1A P08908 2/20 0.35
HTR1B P28222 2/20 0.35
HTR1F P30939 2/20 0.35
HTR1D P28221 1/20 0.35
EGFR P00533 2/20 0.35
FYN P06241 1/20 0.35
PDGFRB P09619 1/20 0.35
FGFR1 P11362 1/20 0.35
PDGFRA P16234 1/20 0.35
PRKACA P17612 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
PRKACG P22612 1/20 0.35
PRKACB P22694 1/20 0.35
MAPK1 P28482 1/20 0.35
KDR P35968 1/20 0.35
EPHB3 P54753 1/20 0.35

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
SCHEMBL6957649 0.97 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6966924 0.96 KMT2A (0.34) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6958624 0.94 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6966508 0.91 KMT2A (0.37) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6969827 0.91 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6963615 0.90 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6961488 0.90 KMT2A (0.34) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6957217 0.89 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6969919 0.88 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F
SCHEMBL6969924 0.88 KMT2A (0.35) KMT2AMARK3HTR1AHTR1BHTR1F

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 2 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