SCHEMBL6137875

SCHEMBL6137875

COC(=O)c1c(Cl)ccc2nc[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.39
NR4A2 P43354 3/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 2/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
QPCT Q16769 1/20 0.36
KDM4E B2RXH2 2/20 0.36

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
SCHEMBL6137727 0.90 NQO2 (0.34) MKNK1NR4A2LMNASMN1; SMN2KMT2A
SCHEMBL6137710 0.81 DPP4 (0.44) LMNASMN1; SMN2TDP1GAAHTT
SCHEMBL13601850 0.78 NQO2 (0.39) MKNK1SMN1; SMN2KMT2AGAAKDM4E
SCHEMBL6137870 0.76 NR4A2 (0.40) NR4A2LMNASMN1; SMN2TSHRGAA
SCHEMBL536590 0.72 KDM4E (0.46) MKNK1NR4A2LMNAKMT2ATDP1
SCHEMBL543109 0.71 PLA2G2A (0.44) NR4A2LMNASMN1; SMN2KMT2ATSHR
Potassium SCHEMBL29729324 0.71 KDM4E (0.45) MKNK1NR4A2LMNAKMT2ATDP1
SCHEMBL31732891 0.70 MKNK1 (0.36) MKNK1NR4A2KMT2ACA12CA1
SCHEMBL7348969 0.70 PARP1 (0.37) SMN1; SMN2TSHRHTTKDM4EALDH1A1
SCHEMBL1081072 0.70 HPGD (0.35) MKNK1LMNASMN1; SMN2KMT2ATDP1

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
EP-1515956-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM (US) 2005-08-10 EP disclosed
EP-1515956-A1 PEPTIDE DEFORMYLASE INHIBITORS Smithkline Beecham (US) 2005-03-23 EP disclosed
WO-2003104209-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-18 WO disclosed