SCHEMBL4253479

SCHEMBL4253479

CC(C)C[C@H](NC(=O)c1cc2ccccc2s1)C(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccccc2C#N)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.54
CTSK P43235 9/20 0.52
TAS1R3 Q7RTX0 2/20 0.46
TAS1R1 Q7RTX1 2/20 0.46
CTSS P25774 3/20 0.46
CTSB P07858 2/20 0.46
TRPV4 Q9HBA0 2/20 0.45
CTSL P07711 2/20 0.42
CTSV O60911 1/20 0.42

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
SCHEMBL5523428 1.00 UTS2R (0.54) UTS2RCTSKTAS1R3TAS1R1CTSS
SCHEMBL14342616 1.00 UTS2R (0.54) UTS2RCTSKTAS1R3TAS1R1CTSS
SCHEMBL4252396 0.91 UTS2R (0.45) UTS2RCTSKCTSSCTSBTRPV4
SCHEMBL14342662 0.90 UTS2R (0.44) UTS2RCTSKCTSSCTSB
SCHEMBL5518167 0.90 UTS2R (0.44) UTS2RCTSKCTSSCTSB
SCHEMBL4075170 0.90 UTS2R (0.44) UTS2RCTSKCTSSCTSB
SCHEMBL4076026 0.90 UTS2R (0.53) UTS2RCTSKTAS1R3TAS1R1CTSS
SCHEMBL4074839 0.89 UTS2R (0.43) UTS2RCTSKCTSSCTSBCTSL
SCHEMBL14342666 0.89 UTS2R (0.43) UTS2RCTSKCTSSCTSBCTSL
SCHEMBL8270899 0.89 CTSK (0.58) UTS2RCTSKTAS1R3TAS1R1CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293477-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION 2007-12-20 US claimed
EP-1796793-A4 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2009-08-05 EP disclosed
US-20070293477-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION 2007-12-20 US disclosed
US-20070293477-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION 2007-12-20 US disclosed
US-20070293477-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION 2007-12-20 US disclosed
EP-1796793-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-06-20 EP disclosed
WO-2006029154-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-03-16 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-20070293477-A1 Novel Compounds HRH4, TRPV4, TRPC4 UTS2R 315/4885CTSK 2064/4885TAS1R3 923/4885

“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.