SCHEMBL6693433

SCHEMBL6693433

CS(=O)(=O)c1ccc(CNc2cccc(NCc3ccc(F)cc3Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.49
PTGS2 P35354 6/20 0.47
NR1H2 P55055 2/20 0.45
NR1H3 Q13133 2/20 0.45
PTGS1 P23219 1/20 0.43
GHSR Q92847 1/20 0.42
VNN1 O95497 1/20 0.42
KMT2A Q03164 2/20 0.41
PPARA Q07869 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL6693546 0.83 FFAR1 (0.49) BRD4PTGS2PTGS1GHSRVNN1
SCHEMBL6691549 0.82 TP53 (0.48) KMT2AMEN1LMNAMAPT
SCHEMBL7208469 0.81 MAPT (0.39) BRD4KMT2APPARAMEN1LMNA
SCHEMBL6692382 0.81 PTGS2 (0.51) BRD4PTGS2PTGS1GHSRVNN1
SCHEMBL6695981 0.78 LMNA (0.51) KMT2AMEN1LMNAGAAMAPT
SCHEMBL6696110 0.78 RXFP1 (0.46) BRD4PTGS2PTGS1GHSRVNN1
SCHEMBL6693953 0.75 MAPT (0.65) KMT2AMEN1LMNAGAAMAPT
SCHEMBL6693419 0.75 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL15078830 0.75 NR1H2 (0.64) PTGS2NR1H2NR1H3VNN1MAPT
SCHEMBL6691735 0.74 CA1 (0.60) PTGS2GHSRGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups 4SC AG (DE) 2004-01-15 US disclosed
WO-2003076388-A2 BIS-ANILINE DERIVATIVES USEFUL AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2003-09-18 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-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups PAH, PNMT, OPRM1 BRD4 878/4885PTGS2 2364/4885NR1H2 585/4885

“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.