SCHEMBL1350982

SCHEMBL1350982

Cc1ccc(N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 7/20 0.48
CTSK P43235 2/20 0.46
F10 P00742 1/20 0.46
PIM1 P11309 1/20 0.46
PIM3 Q86V86 1/20 0.46
PIM2 Q9P1W9 1/20 0.46
USP30 Q70CQ3 2/20 0.45
KDM4D Q6B0I6 3/20 0.44
SYK P43405 1/20 0.44
MAP4K4 O95819 2/20 0.43
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 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
SCHEMBL1350984 1.00 SUV39H2 (0.48) SUV39H2CTSKF10PIM1PIM3
SCHEMBL6486070 0.91 SUV39H2 (0.50) SUV39H2CTSKF10PIM1PIM3
SCHEMBL1350092 0.91 SUV39H2 (0.49) SUV39H2CTSKF10PIM1PIM3
SCHEMBL1350090 0.91 SUV39H2 (0.49) SUV39H2CTSKF10PIM1PIM3
SCHEMBL25453975 0.88 SUV39H2 (0.55) SUV39H2CTSKPIM1PIM3PIM2
SCHEMBL31124502 0.87 SUV39H2 (0.47) SUV39H2CTSKF10PIM1PIM3
SCHEMBL28603267 0.87 SUV39H2 (0.47) SUV39H2CTSKF10PIM1PIM3
SCHEMBL13466330 0.87 PIM1 (0.48) SUV39H2CTSKF10PIM1PIM3
SCHEMBL28603266 0.87 SUV39H2 (0.47) SUV39H2CTSKF10PIM1PIM3
SCHEMBL7235725 0.87 SUV39H2 (0.48) SUV39H2CTSKPIM1PIM3PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063078-B2 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain GLAXOSMITHKLINE LLC (US) 2011-11-22 US disclosed
EP-2298757-A2 Urea compounds active as vanilloid receptor antagonist for the treatment of pain Glaxo Group Limited (GB) 2011-03-23 EP disclosed
US-20090163506-A1 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain SMITHKLINE BEECHAM PLC. (GB) 2009-06-25 US disclosed
EP-2036902-A2 Urea compounds active as vanilloid receptor antagonist for the treatment of pain Glaxo Group Limited (GB) 2009-03-18 EP disclosed
EP-1392651-A1 HETEROCYCLIC UREAS, THEIR PREPARATION AND THEIR USE AS VANILLOID RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2004-03-03 EP disclosed
WO-2002090326-A1 HETEROCYCLIC UREAS, THEIR PREPARATION AND THEIR USE AS VANILLOID RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM P.L.C. (GB) 2002-11-14 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-20090163506-A1 Urea-compounds active as vanilloid receptor antagonists for the treatment of pain TRPV1, OPRL1, UTS2R SUV39H2 2096/4885CTSK 3250/4885F10 1208/4885

“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.