SCHEMBL4184025

SCHEMBL4184025

C[C@@H](CC1CCCC1)NCc1ccccc1NS(=O)(=O)c1ccc(-n2ccnn2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
CCR1 P32246 9/20 0.37
CCR2 P41597 9/20 0.37
CCR4 P51679 7/20 0.37
ACLY P53396 1/20 0.37
LMNA P02545 2/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
SCN9A Q15858 3/20 0.36
ALDH1A1 P00352 1/20 0.36
MOGAT2 Q3SYC2 3/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL4201552 0.99 KDM4E (0.40) KDM4EPKMCCR1CCR2CCR4
SCHEMBL4193413 0.90 ACLY (0.48) KDM4EPKMACLYLMNATP53
SCHEMBL4184085 0.89 ACLY (0.47) KDM4EPKMACLYLMNATP53
SCHEMBL4194889 0.89 ACLY (0.47) KDM4EPKMACLYLMNATP53
SCHEMBL4190556 0.89 KDM4E (0.43) KDM4EPKMACLYLMNATP53
SCHEMBL4198310 0.88 KDM4E (0.44) KDM4EPKMACLYLMNATP53
SCHEMBL4190733 0.88 KDM4E (0.45) KDM4EPKMCCR1CCR2CCR4
SCHEMBL4197688 0.88 KDM4E (0.45) KDM4EPKMCCR1CCR2CCR4
SCHEMBL4203965 0.86 KDM4E (0.39) KDM4EPKMCCR1CCR2CCR4
SCHEMBL4185999 0.85 KDM4E (0.40) KDM4EPKMCCR1CCR2CCR4

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 8 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
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 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-20090215764-A1 Antimicrobial agents TUFM, RPS17, HARS1 KDM4E 3328/4885PKM 1855/4885CCR1 3024/4885

“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.