SCHEMBL4195566

SCHEMBL4195566

COc1ccc(-c2ccc(S(=O)(=O)Nc3ccccc3CN[C@@H](C)CC3CCCC3)s2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 15/20 0.43
MMP1 P03956 10/20 0.43
MMP2 P08253 4/20 0.43
MMP9 P14780 3/20 0.43
MMP3 P08254 3/20 0.41
MMP8 P22894 1/20 0.38
GHSR Q92847 1/20 0.36
HTT P42858 1/20 0.36
NLRP3 Q96P20 1/20 0.36

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
SCHEMBL4195119 0.92 GHSR (0.38) MMP13MMP1MMP2MMP9MMP3
SCHEMBL4198289 0.92 GHSR (0.38) MMP13MMP1MMP2MMP9MMP3
SCHEMBL4197564 0.91 KDM4E (0.39) MMP13MMP1MMP2MMP9MMP3
SCHEMBL4185970 0.90 KDM4E (0.40) MMP13MMP1MMP2MMP9GHSR
SCHEMBL4203717 0.90 MMP13 (0.43) MMP13MMP1
SCHEMBL4188180 0.89 MMP13 (0.43) MMP13MMP1
SCHEMBL4196866 0.89 MMP13 (0.41) MMP13GHSR
SCHEMBL4189890 0.88 MMP13 (0.40) MMP13GHSR
SCHEMBL4195287 0.88 MMP13 (0.40) MMP13GHSR
SCHEMBL4190359 0.88 TP53 (0.41) GHSRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP claimed
US-8076370-B2 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2011-12-13 US claimed
US-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 US claimed
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP disclosed
US-8076370-B2 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2011-12-13 US disclosed
US-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 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 (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-20090215764-A1 Antimicrobial agents TUFM, RPS17, HARS1 MMP13 4330/4885MMP1 3346/4885MMP2 1728/4885

“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.