SCHEMBL5114370

SCHEMBL5114370

O=C(CCCCNCS(=O)(=O)c1c(Cl)cccc1Cl)CNCc1ccc(C2=NCCN2C(=O)O)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
ALDH1A1 P00352 3/20 0.31
KMT2A Q03164 3/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
POLB P06746 1/20 0.30
THRB P10828 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
NCOR2 Q9Y618 1/20 0.30

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
SCHEMBL5125286 0.94 ALDH1A1 (0.33) TSHRALDH1A1KMT2AMEN1HTT
SCHEMBL5126340 0.91 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL5126502 0.91 KMT2A (0.34) ALDH1A1KMT2AMEN1HTTHDAC3
SCHEMBL5119112 0.89 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL5119728 0.87 LMNA (0.31)
SCHEMBL5115144 0.87 BDKRB1 (0.33) TSHRALDH1A1
SCHEMBL6762664 0.87 ALDH1A1 (0.34) TSHRALDH1A1KMT2AMEN1HTT
SCHEMBL5117882 0.86 CNR1 (0.34) ALDH1A1
SCHEMBL5118642 0.85 SMN1; SMN2 (0.32) KMT2AMEN1SMN1; SMN2
SCHEMBL5124696 0.85 LMNA (0.41) KMT2AMEN1POLBTHRB

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-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 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-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents UGT1A1, UGT2B7, UGT1A6 TSHR 3038/4885ALDH1A1 73/4885KMT2A 3755/4885

“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.