SCHEMBL5383412

SCHEMBL5383412

NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.65
NMBR P28336 2/20 0.63
MMP2 P08253 9/20 0.61
MMP9 P14780 9/20 0.61
MMP8 P22894 9/20 0.61
MMP14 P50281 9/20 0.61
MAPT P10636 2/20 0.60
GAA P10253 1/20 0.60
HTT P42858 1/20 0.60
ECE1 P42892 1/20 0.59
LMNA P02545 1/20 0.58
MMP11 P24347 2/20 0.58
CA2 P00918 1/20 0.58
LNPEP Q9UIQ6 1/20 0.58
MMP7 P09237 1/20 0.57

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
SCHEMBL5391056 0.92 BMP1 (0.67) BMP1NMBRMMP9MMP8MAPT
SCHEMBL5395723 0.90 BMP1 (0.65) BMP1NMBRMMP9MMP8MAPT
SCHEMBL5381814 0.90 NMBR (0.73) NMBRMMP2MMP9MMP8MMP14
SCHEMBL1711383 0.90 NMBR (0.73) NMBRMMP2MMP9MMP8MMP14
SCHEMBL29472048 0.90 NMBR (0.73) NMBRMMP2MMP9MMP8MMP14
SCHEMBL5383117 0.89 BMP1 (0.63) BMP1NMBRMMP9MMP8MAPT
SCHEMBL5556658 0.86 NMBR (0.74) NMBRMMP2MMP9MMP8MMP14
SCHEMBL5399966 0.84 NMBR (0.71) NMBRMMP2MMP9MMP8MMP14
SCHEMBL29404813 0.84 MMP9 (0.64) BMP1NMBRMMP9MMP8MAPT
SCHEMBL27951093 0.83 TACR1 (0.71) NMBRMAPTLMNALNPEP

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-7163671-B2 Long-term stabilized formulations CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-01-16 US disclosed
US-20030092622-A1 Preparation stabilized over long time CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-05-15 US disclosed
EP-1260230-A1 PREPARATIONS STABILIZED OVER LONG TIME CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-11-27 EP disclosed