SCHEMBL7135014

SCHEMBL7135014

O=C(O)CCCCCNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.63
BMP1 P13497 1/20 0.62
BRS3 P32247 4/20 0.61
NMBR P28336 3/20 0.59
MEN1 O00255 1/20 0.57
HCRTR1 O43613 1/20 0.57
KMT2A Q03164 1/20 0.57
EPHX2 P34913 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
SCHEMBL7135018 1.00 MMP1 (0.63) MMP1BMP1BRS3NMBRMEN1
SCHEMBL1233776 0.94 BMP1 (0.68) MMP1BMP1BRS3NMBR
SCHEMBL7257081 0.89 NMBR (0.64) BMP1BRS3NMBR
SCHEMBL7252292 0.89 BRS3 (0.64) BMP1BRS3NMBR
SCHEMBL7256825 0.88 BMP1 (0.63) BMP1BRS3NMBR
SCHEMBL7255942 0.88 BRS3 (0.65) BMP1BRS3NMBRKMT2A
Hydrochloric Acid SCHEMBL7251808 0.87 BMP1 (0.62) BMP1BRS3NMBR
SCHEMBL1233724 0.87 HDAC3 (0.67) MMP1BMP1NMBRMEN1HCRTR1
SCHEMBL7138854 0.87 HDAC3 (0.67) MMP1BMP1NMBRMEN1HCRTR1
SCHEMBL1233735 0.86 BMP1 (0.63) MMP1BMP1BRS3NMBRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1335898-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS Prolifix Limited (GB) 2003-08-20 EP disclosed
WO-2002026696-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS PROLIFIX LIMITED (GB) 2002-04-04 WO disclosed