SCHEMBL877579

SCHEMBL877579

COc1ccc(C(=O)Nc2ccc(S(=O)(=O)C(CCn3nnc4ccccc4c3=O)C(=O)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MMP9 P14780 4/20 0.48
MMP2 P08253 4/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.48
GPR139 Q6DWJ6 4/20 0.47
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 2/20 0.45
HPGD P15428 1/20 0.45
MMP3 P08254 2/20 0.44
MMP13 P45452 2/20 0.44
UBE2N P61088 1/20 0.44
MMP1 P03956 1/20 0.44

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
SCHEMBL874492 0.92 KMT2A (0.49) KMT2AMMP9MMP2KDM4EMEN1
SCHEMBL875118 0.91 TSHR (0.52) KMT2AMMP2KDM4ELMNAGPR139
SCHEMBL874410 0.91 HTT (0.54) KMT2AMMP9MMP2KDM4ELMNA
SCHEMBL874966 0.90 GPR139 (0.49) KMT2AMMP9MMP2KDM4ELMNA
SCHEMBL875318 0.89 KMT2A (0.46) KMT2AMMP9MMP2KDM4EGPR139
SCHEMBL878191 0.89 ALDH1A1 (0.49) KMT2AMMP9MMP2KDM4EGPR139
SCHEMBL875435 0.88 GPR139 (0.49) MMP9MMP2KDM4ELMNAGPR139
SCHEMBL874772 0.87 KMT2A (0.47) KMT2AKDM4EGPR139MEN1ALDH1A1
SCHEMBL877932 0.87 KMT2A (0.47) KMT2AKDM4EMEN1ALDH1A1HSD17B10
SCHEMBL875017 0.85 HTT (0.47) KMT2AKDM4ELMNAGPR139MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US claimed
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US disclosed
EP-2619185-A1 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2013-07-31 EP disclosed
WO-2012038942-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-03-29 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 (1 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-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP12, MMP10 KMT2A 3501/4885MMP9 1/4885MMP2 17/4885

“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.