SCHEMBL3728748

SCHEMBL3728748

Cc1ccc(-c2ccc(CC[C@@H](O)[C@H](Cn3nnc4ccccc4c3=O)C(=O)O)cc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 7/20 0.48
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MMP2 P08253 4/20 0.42
MMP3 P08254 4/20 0.42
MMP9 P14780 4/20 0.42
MMP13 P45452 4/20 0.42
MMP1 P03956 2/20 0.42
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL1842004 0.92 GPR139 (0.47) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL3738706 0.90 GPR139 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL3735440 0.89 GPR139 (0.46) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL3730307 0.88 GPR139 (0.47) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL1843457 0.86 MMP2 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL1844872 0.86 SMN1; SMN2 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL4221498 0.86 SMN1; SMN2 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL4205576 0.86 MMP2 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL1841923 0.86 SMN1; SMN2 (0.54) GPR139GAAL3MBTL1MMP2MMP3
SCHEMBL4566786 0.84 GPR139 (0.47) GPR139GAAL3MBTL1MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130302378-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2013-11-14 US claimed
US-8507670-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-08-13 US claimed
EP-2074093-B1 PROCESS FOR PREPARING MATRIX METALLOPROTEINASE INHIBITORS AND CHIRAL AUXILIARY THEREFOR RANBAXY LAB LTD (IN) 2012-10-10 EP claimed
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2010-04-01 US claimed
US-8846910-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2014-09-30 US disclosed
US-8816073-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2014-08-26 US disclosed
US-20130302378-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2013-11-14 US disclosed
US-20130295141-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2013-11-07 US disclosed
US-8507670-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-08-13 US disclosed
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2010-04-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130302378-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP25 GPR139 2210/4885GAA 614/4885L3MBTL1 3157/4885
US-20130295141-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP25 GPR139 2210/4885GAA 614/4885L3MBTL1 3157/4885
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP12 GPR139 2377/4885GAA 510/4885L3MBTL1 3152/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.