SCHEMBL877143

SCHEMBL877143

COC(CCNS(C)(=O)=O)(C(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.40
MMP1 P03956 2/20 0.40
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
MMP3 P08254 1/20 0.40
MMP14 P50281 1/20 0.40
CYP2C9 P11712 1/20 0.39
POLB P06746 2/20 0.38
MMP12 P39900 2/20 0.38
SLC6A2 P23975 1/20 0.38
GAA P10253 1/20 0.37
SLC6A3 Q01959 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL2364636 0.72 MTNR1A (0.46) SMN1; SMN2
SCHEMBL878149 0.70 POLB (0.44) POLBKDM4ETSHRRECQLNPC1
SCHEMBL877144 0.69 MMP12 (0.38) MMP13MMP1MMP2MMP9MMP14
SCHEMBL877680 0.69 POLB (0.43) POLBKDM4ETSHRRECQLMEN1
SCHEMBL5579019 0.67 PPARG (0.49) MMP3
SCHEMBL10312250 0.67 POLB (0.64) MMP13POLBMMP12SLC6A2MEN1
SCHEMBL2729130 0.66 CES1 (0.46) TSHRKMT2A
SCHEMBL13670592 0.65 HDAC1 (0.57) POLBKDM4ERAB9ASMN1; SMN2
SCHEMBL877145 0.65 CYP2C9 (0.40) MMP13MMP1MMP2MMP9MMP3
SCHEMBL28753479 0.65 CES1 (0.44) TSHRRECQLSMN1; SMN2KMT2A

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-2619179-A1 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2013-07-31 EP claimed
WO-2012038944-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-03-29 WO claimed