SCHEMBL3728757

SCHEMBL3728757

COc1ccc(-c2ccc(C=CC(=O)O)cc2)cn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.56
MKNK2 Q9HBH9 1/20 0.56
THRB P10828 1/20 0.55
ATM Q13315 1/20 0.55
NPC1 O15118 4/20 0.53
RAB9A P51151 3/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
LMNA P02545 3/20 0.52
MAPT P10636 1/20 0.52
HSD17B1 P14061 1/20 0.48
HSD17B2 P37059 1/20 0.48
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MITF O75030 1/20 0.47
KLF5 Q13887 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL3728756 1.00 MKNK1 (0.56) MKNK1MKNK2THRBATMNPC1
SCHEMBL20139654 0.88 P4HTM (0.58) THRBATMNPC1RAB9ASMN1; SMN2
SCHEMBL1124610 0.88 P4HTM (0.58) THRBATMNPC1RAB9ASMN1; SMN2
SCHEMBL30034522 0.88 P4HTM (0.58) THRBATMNPC1RAB9ASMN1; SMN2
SCHEMBL1124609 0.88 P4HTM (0.58) THRBATMNPC1RAB9ASMN1; SMN2
SCHEMBL1843115 0.87 MKNK1 (0.55) MKNK1MKNK2NPC1RAB9ASMN1; SMN2
SCHEMBL9157078 0.82 MKNK1 (0.52) MKNK1MKNK2NPC1RAB9ASMN1; SMN2
SCHEMBL9157074 0.82 MKNK1 (0.52) MKNK1MKNK2NPC1RAB9ASMN1; SMN2
SCHEMBL1843120 0.78 MKNK1 (0.55) MKNK1MKNK2NPC1RAB9ALMNA
SCHEMBL7967988 0.78 THRB (0.89) THRBATMNPC1RAB9ASMN1; SMN2

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-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
EP-2074093-B1 PROCESS FOR PREPARING MATRIX METALLOPROTEINASE INHIBITORS AND CHIRAL AUXILIARY THEREFOR RANBAXY LAB LTD (IN) 2012-10-10 EP disclosed
EP-2474531-A2 Matrix metalloproteinase inhibitors Ranbaxy Laboratories Limited (IN) 2012-07-11 EP disclosed
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2010-04-01 US disclosed
EP-2074093-A2 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-07-01 EP disclosed
WO-2008023336-A2 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-02-28 WO 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 MKNK1 2892/4885MKNK2 3521/4885THRB 2107/4885
US-20130295141-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP25 MKNK1 2892/4885MKNK2 3521/4885THRB 2107/4885
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP12 MKNK1 2918/4885MKNK2 3569/4885THRB 2195/4885

“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.