SCHEMBL6542598

SCHEMBL6542598

CN(C)CCOc1cc(NS(=O)(=O)c2cccc3c(Cl)cccc23)ccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.49
UTS2R Q9UKP6 4/20 0.47
WDR5 P61964 1/20 0.46
EDNRA P25101 2/20 0.46
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL6542775 0.89 UTS2R (0.52) UTS2RMEN1ALDH1A1KMT2A
SCHEMBL6542032 0.82 HTR6 (0.61) HTR6UTS2RMEN1ALDH1A1KMT2A
SCHEMBL6542559 0.81 PPARG (0.48) UTS2RMEN1ALDH1A1KMT2A
SCHEMBL6542576 0.81 UTS2R (0.60) UTS2RMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6541415 0.81 UTS2R (0.48) UTS2RMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6542101 0.81 HSD17B1 (0.50) HTR6UTS2RMEN1ALDH1A1KMT2A
SCHEMBL6542115 0.81 UTS2R (0.48) UTS2REDNRAKDM4EMEN1ALDH1A1
SCHEMBL6541222 0.81 PTGES2 (0.49) UTS2RKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6542588 0.79 UTS2R (0.48) HTR6UTS2RALDH1A1
SCHEMBL6542141 0.79 UTS2R (0.49) UTS2RKDM4EMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1248607-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-06 EP claimed
US-20030100580-A1 Urotensin-II receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-05-29 US claimed
EP-1248607-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-10-16 EP claimed
WO-2001045694-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-06-28 WO claimed
EP-1248607-A4 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-06 EP disclosed
US-20030100580-A1 Urotensin-II receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-05-29 US disclosed
EP-1248607-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-10-16 EP disclosed
WO-2001045694-A1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-06-28 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-20030100580-A1 Urotensin-II receptor antagonists UTS2R, TMPRSS4, PLAUR HTR6 669/4885UTS2R 1/4885WDR5 3883/4885

“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.