SCHEMBL6024311

SCHEMBL6024311

NN(C(=O)Cc1ccccc1)C(=O)C(Cc1ccc(Cl)c(Cl)c1)CN(O)C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 2/20 0.38
SIGMAR1 Q99720 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
UTS2R Q9UKP6 1/20 0.36
PDPK1 O15530 1/20 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
SCHEMBL6024228 0.84 FAAH (0.41) MEN1KMT2AALDH1A1PDPK1
SCHEMBL6024263 0.79 HTT (0.50) KMOMEN1KMT2AHTTSIGMAR1
SCHEMBL3895767 0.78 PNMT (0.42) KMOTSHRPDPK1
SCHEMBL6023477 0.75 BMP1 (0.49)
SCHEMBL6024284 0.74 ATM (0.43)
SCHEMBL6024223 0.73 HTT (0.45) MEN1KMT2ASMN1; SMN2HTTALDH1A1
SCHEMBL6024597 0.71 HDAC8 (0.43) ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL3895761 0.70 PNMT (0.40) SIGMAR1TSHRPDPK1
SCHEMBL3903096 0.69 CYP1A2 (0.49) ALDH1A1CYP1A2
SCHEMBL7811346 0.66 HPGD (0.47) KMOMEN1KMT2A

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-1363873-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2006-01-04 EP claimed
EP-1363873-A2 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2003-11-26 EP claimed
WO-2002070541-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITH KLINE BEECHAM CORPORATION (US) 2002-09-12 WO claimed