SCHEMBL8895948

SCHEMBL8895948

CC(C)C[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.72
FCER2 P06734 3/20 0.72
MME P08473 2/20 0.69
ERAP2 Q6P179 3/20 0.62
ERAP1 Q9NZ08 3/20 0.62
LNPEP Q9UIQ6 3/20 0.62
ACE P12821 1/20 0.59
MMP2 P08253 1/20 0.58
MMP7 P09237 1/20 0.58
MMP9 P14780 1/20 0.58
MMP12 P39900 1/20 0.58
MMP13 P45452 1/20 0.58

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
SCHEMBL8895943 1.00 MMP1 (0.72) MMP1FCER2MMEERAP2ERAP1
SCHEMBL8899092 0.94 MME (0.68) MMP1FCER2MMEERAP2ERAP1
SCHEMBL8899095 0.94 MME (0.68) MMP1FCER2MMEERAP2ERAP1
SCHEMBL8898699 0.90 MME (0.63) MMP1FCER2MMEERAP2ERAP1
SCHEMBL8898706 0.90 MME (0.63) MMP1FCER2MMEERAP2ERAP1
SCHEMBL4226365 0.90 MME (0.63) MMP1FCER2MMEERAP2ERAP1
SCHEMBL11404202 0.90 MME (0.81) MMP1FCER2MME
SCHEMBL11404199 0.90 MME (0.81) MMP1FCER2MME
SCHEMBL9068522 0.90 MME (0.81) MMEMMP2MMP7MMP9MMP12
SCHEMBL9751225 0.90 MME (0.81) MMEMMP2MMP7MMP9MMP12

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
US-5686422-A Synthetic inhibitors of mammalian collagenase RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-11-11 US disclosed
EP-0358660-B1 SYNTHETIC INHIBITORS OF MAMMALIAN COLLAGENASE RES CORP TECHNOLOGIES INC (US) 1994-05-25 EP disclosed