SCHEMBL6962207

SCHEMBL6962207

Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3cc(OC(=O)c4ccc(Cl)cc4)ccc3C2C)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LIPE Q05469 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
ALK Q9UM73 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR1F P30939 1/20 0.33
SCN9A Q15858 3/20 0.33
SRC P12931 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL6958506 0.94 SMN1; SMN2 (0.39) SMN1; SMN2NPSR1KMT2AMEN1HTR2A
SCHEMBL6957582 0.93 CCNE1 (0.39) NPSR1TP53KDM4ECCNE1CDK2
SCHEMBL6961412 0.92 SMN1; SMN2 (0.37) SMN1; SMN2NPSR1KMT2AHTR2AHTR2C
SCHEMBL6957959 0.92 SMN1; SMN2 (0.38) SMN1; SMN2NPSR1KMT2AMEN1HTR2A
SCHEMBL6957189 0.91 SMN1; SMN2 (0.37) SMN1; SMN2NPSR1KMT2AMEN1HTR2A
SCHEMBL6964622 0.91 SMN1; SMN2 (0.37) SMN1; SMN2NPSR1HTR1AHTR1DHTR1B
SCHEMBL6957084 0.90 KMT2A (0.33) SMN1; SMN2NPSR1LIPEKMT2ASCN9A
SCHEMBL6959003 0.90 TP53 (0.41) SMN1; SMN2NPSR1KMT2AMEN1TP53
SCHEMBL6958365 0.90 MAPT (0.38) SMN1; SMN2NPSR1KMT2AHTR2AHTR2C
SCHEMBL6961241 0.90 HTR2A (0.36) SMN1; SMN2NPSR1KMT2AMEN1HTR2A

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 5 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
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