SCHEMBL5345484

SCHEMBL5345484

CC(C)C(CO)N(Cc1cccc(Br)n1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.34
AAK1 Q2M2I8 1/20 0.31
TRPV3 Q8NET8 2/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 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
SCHEMBL14558308 0.88 SSTR4 (0.35) SSTR4AAK1SIRT2IRAK4HTR2C
SCHEMBL5337903 0.87 CHRNB2 (0.31) SSTR4SIRT2IRAK4
SCHEMBL5428116 0.87 SSTR4 (0.34) SSTR4AAK1SIRT2IRAK4HTR2C
SCHEMBL5345555 0.83 SSTR4 (0.31) SSTR4AAK1SIRT2
SCHEMBL5348846 0.83 TRPV3 (0.34) TRPV3SIRT2
SCHEMBL5342203 0.83 SSTR4 (0.32) SSTR4AAK1TRPV3SIRT2IRAK4
SCHEMBL7246522 0.81 CHRNB2 (0.36) TRPV3
SCHEMBL14558307 0.80 MAPT (0.32) SSTR4AAK1SIRT2IRAK4
SCHEMBL3511518 0.78 HTR2C (0.45) SSTR4HTR2CSLC6A4
SCHEMBL5354963 0.74 XIAP (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
EP-1392306-A1 SUBSTITUTED TETRAHYDROISOQUINOLINES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES Aventis Pharma Limited (GB) 2004-03-03 EP disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US disclosed
WO-2002098426-A1 SUBSTITUTED TETRAHYDROISOQUINOLINES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES AVENTIS PHARMA LIMTIED (GB) 2002-12-12 WO disclosed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 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 (4 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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX SSTR4 2822/4885AAK1 1295/4885TRPV3 3414/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX SSTR4 3309/4885AAK1 2502/4885TRPV3 4231/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX SSTR4 2822/4885AAK1 1295/4885TRPV3 3414/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX SSTR4 2822/4885AAK1 1295/4885TRPV3 3414/4885

“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.