SCHEMBL4188260

SCHEMBL4188260

C[C@@H](CC1CCCC1)NCc1ccccc1NS(=O)(=O)c1ccc2nc(O)c(O)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 5/20 0.42
MAPT P10636 7/20 0.39
TP53 P04637 3/20 0.39
LMNA P02545 8/20 0.37
POLB P06746 3/20 0.37
THRB P10828 1/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
SLC16A3 O15427 1/20 0.36
PIK3CG P48736 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL4191257 0.99 PKM (0.45) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4192397 0.86 TSHR (0.50) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4194915 0.86 ALDH1A1 (0.44) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4190737 0.85 ALDH1A1 (0.43) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4193445 0.83 KDM4E (0.46) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4197657 0.82 ALDH1A1 (0.44) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4190871 0.82 MAPT (0.49) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4197363 0.82 KDM4E (0.41) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4203970 0.82 KDM4E (0.41) PKMKDM4EALDH1A1MAPTTP53
SCHEMBL4192361 0.82 GLO1 (0.47) PKMKDM4EALDH1A1MAPTTP53

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 PKM 1855/4885KDM4E 3328/4885ALDH1A1 2744/4885

“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.