SCHEMBL6024265

SCHEMBL6024265

CCCCC[C@H](CN(O)C=O)C(=O)N(N)C(=O)[C@@H]1CCC(=O)N1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.41
PTGER4 P35408 4/20 0.40
PTGER2 P43116 3/20 0.39
PTGER3 P43115 2/20 0.39
ITGB1 P05556 2/20 0.39
ITGA4 P13612 2/20 0.39
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2C9 P11712 1/20 0.37
USP2 O75604 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX15 P16050 1/20 0.37
MEN1 O00255 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
SCHEMBL6026461 0.83 BMP1 (0.46) BMP1ITGB1ITGA4ALDH1A1TSHR
SCHEMBL6024632 0.83 BMP1 (0.46) BMP1ITGB1ITGA4ALDH1A1TSHR
SCHEMBL6023477 0.76 BMP1 (0.49) BMP1
SCHEMBL6023712 0.71 BMP1 (0.47) BMP1
SCHEMBL6024296 0.71 BMP1 (0.48) BMP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL6024306 0.71 BMP1 (0.40) BMP1MEN1KMT2A
SCHEMBL6023658 0.69 BMP1 (0.45) BMP1
SCHEMBL6023895 0.69 BMP1 (0.46) BMP1MEN1KMT2A
SCHEMBL6024147 0.69 BMP1 (0.46) BMP1MEN1KMT2A
SCHEMBL1596333 0.69 BMP1 (0.49) BMP1KDM4EHSD17B10MEN1KMT2A

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 disclosed
EP-1363873-A2 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2003-11-26 EP disclosed
WO-2002070541-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITH KLINE BEECHAM CORPORATION (US) 2002-09-12 WO disclosed