SCHEMBL2740995

SCHEMBL2740995

O=S(=O)(Nc1ccccc1Cl)c1cccc(Br)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.63
KDM4E B2RXH2 2/20 0.63
PTK2B Q14289 1/20 0.63
WDR5 P61964 1/20 0.62
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
PGR P06401 2/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
BRD4 O60885 1/20 0.51
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
STAT3 P40763 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PTGES2 Q9H7Z7 1/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
FLT1 P17948 1/20 0.49

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
SCHEMBL3791578 0.81 TSHR (0.74) TSHRKDM4EPTK2BMEN1KMT2A
SCHEMBL17779177 0.81 TSHR (0.63) TSHRKDM4EPTK2BMEN1KMT2A
SCHEMBL7594368 0.80 WDR5 (0.60) WDR5MEN1KMT2APGRBRD4
SCHEMBL3641461 0.79 EP300 (0.55) TSHRKDM4EPTK2BWDR5MEN1
SCHEMBL2073110 0.79 CRHBP (0.61) TSHRKDM4EPTK2BWDR5MEN1
SCHEMBL13510519 0.79 EP300 (0.77) WDR5MEN1KMT2ABRD4ALDH1A1
SCHEMBL22441753 0.79 MCL1 (0.66) WDR5MEN1KMT2AALDH1A1LMNA
SCHEMBL31314298 0.79 SLC22A12 (0.54) WDR5PGRMAPTPTGES2FLT1
SCHEMBL3772475 0.79 PTGES2 (0.70) PTGES2
SCHEMBL27845636 0.79 MCOLN3 (0.62) KDM4EWDR5MEN1KMT2APGR

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-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 US disclosed
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 US disclosed
US-20100249135-A1 SULFONAMIDES AND THEIR USE AS A MEDICAMENT THE GENETICS COMPANY, INC. (CH) 2010-09-30 US disclosed
US-20100249135-A1 SULFONAMIDES AND THEIR USE AS A MEDICAMENT THE GENETICS COMPANY, INC. (CH) 2010-09-30 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-20100249135-A1 SULFONAMIDES AND THEIR USE AS A MEDICAMENT BCOR, CBR3, SULT1E1 TSHR 760/4885KDM4E 229/4885PTK2B 2888/4885

“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.