SCHEMBL1153375

SCHEMBL1153375

O=S(=O)(Cl)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.53
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPK1 P28482 1/20 0.49
LMNA P02545 1/20 0.48
SCN9A Q15858 8/20 0.47
RAB9A P51151 1/20 0.46
SCN7A Q01118 2/20 0.45
KCNH2 Q12809 2/20 0.45
SCN5A Q14524 2/20 0.45
IDO1 P14902 1/20 0.45
LIPE Q05469 3/20 0.45
KMT2A Q03164 1/20 0.44
BCHE P06276 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL1154291 0.88 THRB (0.53) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL1154644 0.88 THRB (0.53) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL1154201 0.86 THRB (0.52) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL971589 0.81 MAPT (0.63) THRBMAPTNPSR1LMNARAB9A
SCHEMBL1153627 0.81 LMNA (0.59) MAPTNPSR1LMNARAB9ALIPE
SCHEMBL1154439 0.76 KMT2A (0.51) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL1154417 0.76 THRB (0.51) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL11351938 0.76 MAPT (0.69) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL1154340 0.75 L3MBTL1 (0.52) THRBMAPTNPSR1MAPK1LMNA
SCHEMBL31694849 0.75 THRB (0.59) THRBMAPTNPSR1MAPK1LMNA

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-20110039693-A1 Pyrimidylmethyl Sulfonamide Compounds BASF SE (DE) 2011-02-17 US disclosed
EP-2252606-A1 PYRIMIDYLMETHYL SULFONAMIDE COMPOUNDS BASF SE (DE) 2010-11-24 EP disclosed
WO-2009101078-A1 PYRIMIDYLMETHYL SULFONAMIDE COMPOUNDS BASF SE (DE) 2009-08-20 WO disclosed
WO-2009101079-A1 PYRIMIDYLMETHYL SULFONAMIDE COMPOUNDS BASF SE (DE) 2009-08-20 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-20110039693-A1 Pyrimidylmethyl Sulfonamide Compounds TPMT, NQO2, TST THRB 3469/4885MAPT 4182/4885NPSR1 160/4885

“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.