SCHEMBL5524813

SCHEMBL5524813

CCOC(=O)c1sc(C(C)(C)C)nc1Cc1cccc(NCC(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
NPC1 O15118 3/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 2/20 0.41
CDC7 O00311 4/20 0.41
DBF4 Q9UBU7 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TRPM8 Q7Z2W7 2/20 0.40
CSNK1D P48730 2/20 0.40
DHODH Q02127 4/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 1/20 0.38
PLA2G1B P04054 1/20 0.38
HTT P42858 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
USP2 O75604 1/20 0.38
NFKB1 P19838 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL5520493 0.82 ALDH1A1 (0.46) MAPTNPC1HPGDRAB9ACDC7
SCHEMBL5522721 0.82 TRPM8 (0.53) MAPTNPC1RAB9ACDC7DBF4
SCHEMBL5528919 0.77 TRPM8 (0.55) MAPTNPC1HPGDRAB9ACDC7
SCHEMBL5526019 0.77 TRPM8 (0.45) MAPTNPC1HPGDRAB9ACDC7
SCHEMBL5527731 0.76 CDC7 (0.47) MAPTHPGDCDC7DBF4ALDH1A1
SCHEMBL5522743 0.75 TRPM8 (0.46) MAPTNPC1RAB9ACDC7DBF4
SCHEMBL5522717 0.74 CSNK1D (0.54) MAPTNPC1HPGDRAB9ACDC7
SCHEMBL5520496 0.74 PTPN11 (0.48) MAPTHPGDCDC7DBF4ALDH1A1
SCHEMBL5558956 0.74 MAPT (0.40) MAPTNPC1HPGDRAB9ACDC7
SCHEMBL5520347 0.73 MAPK14 (0.46) MAPTNPC1HPGDRAB9ACDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2012-05-03 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-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS POLI, POLB, POLA1 MAPT 2190/4885NPC1 3623/4885HPGD 563/4885

“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.