SCHEMBL6967711

SCHEMBL6967711

CC(=O)OCc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccccc3C2C)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 2/20 0.37
TRPC6 Q9Y210 2/20 0.37
KCNH3 Q9ULD8 1/20 0.35
MARK3 P27448 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 2/20 0.33
CHRM3 P20309 1/20 0.33
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
KCNK3 O14649 2/20 0.32
LIPE Q05469 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
SCHEMBL6968698 0.94 TRPC3 (0.38) TRPC3TRPC6KCNH3MARK3TRPM8
SCHEMBL6967410 0.92 KCNH3 (0.34) TRPC3TRPC6KCNH3MARK3TRPM8
SCHEMBL6967941 0.92 TRPC3 (0.34) TRPC3TRPC6KCNH3MARK3TRPM8
SCHEMBL6963630 0.91 GAA (0.36) TRPC3TRPC6KCNH3MARK3TRPM8
SCHEMBL6963603 0.91 KCNH3 (0.36) KCNH3THRBKMT2AMEN1KDM4E
SCHEMBL6954449 0.90 NOTUM (0.36) TRPC3TRPC6KCNH3THRBKMT2A
SCHEMBL6955983 0.90 EGFR (0.39) TRPC3TRPC6KCNH3MARK3TRPM8
SCHEMBL6962206 0.90 MAPT (0.36) THRBKMT2AMEN1JAK2JAK1
SCHEMBL6970438 0.90 GAA (0.36) KCNH3MARK3THRBKMT2ACHRM3
SCHEMBL6955988 0.90 EGFR (0.39) TRPC3TRPC6KCNH3MARK3TRPM8

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