SCHEMBL14422232

SCHEMBL14422232

CN(C)c1ccc(NC(=O)c2csc(Cc3c(Cl)cccc3Cl)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 8/20 0.58
CDK5R1 Q15078 8/20 0.58
CCNA2 P20248 6/20 0.58
CDK2 P24941 6/20 0.58
CCNA1 P78396 6/20 0.58
LMNA P02545 8/20 0.56
MAPT P10636 7/20 0.56
SMN1; SMN2 Q16637 6/20 0.56
RAB9A P51151 5/20 0.56
ALDH1A1 P00352 5/20 0.56
NPC1 O15118 4/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
GAA P10253 3/20 0.56
RECQL P46063 2/20 0.56
MAPK1 P28482 1/20 0.56
MCL1 Q07820 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
KMT2A Q03164 2/20 0.56
ALOX12 P18054 1/20 0.52
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL9942086 0.85 LMNA (0.57) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422224 0.85 LMNA (0.60) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422205 0.85 LMNA (0.57) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422223 0.85 LMNA (0.59) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422231 0.84 LMNA (0.56) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422230 0.83 LMNA (0.57) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5215439 0.83 MAPT (0.59) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422225 0.82 LMNA (0.56) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422228 0.82 LMNA (0.56) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14422227 0.82 LMNA (0.56) CDK5CDK5R1CCNA2CDK2CCNA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 US disclosed
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 US disclosed
EP-1818333-A1 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-08-15 EP disclosed