SCHEMBL6965503

SCHEMBL6965503

Cc1c(COC(=O)Cc2cccs2)nc(Nc2ccc(F)cc2)nc1N1CCc2ccccc2C1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 2/20 0.36
POLB P06746 2/20 0.34
TRPC3 Q13507 2/20 0.33
TRPC6 Q9Y210 2/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
BLM P54132 1/20 0.32
RAB9A P51151 1/20 0.31
THRB P10828 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
MAPT P10636 1/20 0.31
ESR2 Q92731 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TP53 P04637 1/20 0.31
GRM5 P41594 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL6967410 0.88 KCNH3 (0.34) KCNH3TRPC3TRPC6MEN1KMT2A
SCHEMBL6954449 0.87 NOTUM (0.36) KCNH3TRPC3TRPC6MEN1KMT2A
SCHEMBL6967711 0.86 TRPC3 (0.37) KCNH3TRPC3TRPC6MEN1KMT2A
SCHEMBL6964419 0.86 KLK7 (0.40) KCNH3RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL6962395 0.85 GAA (0.36) KCNH3TRPC3TRPC6KMT2ARAB9A
SCHEMBL6967941 0.85 TRPC3 (0.34) KCNH3TRPC3TRPC6MEN1KMT2A
SCHEMBL6963603 0.84 KCNH3 (0.36) KCNH3POLBMEN1KMT2ARAB9A
SCHEMBL6963630 0.84 GAA (0.36) KCNH3TRPC3TRPC6MEN1KMT2A
Hydrochloric Acid SCHEMBL6967875 0.84 KDM4E (0.38) KCNH3POLBMEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL6961096 0.84 KDM4E (0.34) KCNH3TRPC3TRPC6BLMTHRB

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 6 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
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US 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
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