SCHEMBL5339185

SCHEMBL5339185

O=C(Nc1cccc(C(=O)N2CCCCC2)n1)Nc1csc(-c2cccnc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 7/20 0.51
CDK5 Q00535 5/20 0.49
CDK5R1 Q15078 5/20 0.49
TLR7 Q9NYK1 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
CHEK1 O14757 1/20 0.44
USP2 O75604 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
DYRK1A Q13627 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CCNA2 P20248 1/20 0.42
CDK2 P24941 1/20 0.42
CCNA1 P78396 1/20 0.42
NPC1 O15118 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
SCHEMBL5383590 0.90 CDK5 (0.60) CDK5CDK5R1CHEK1MAPTDYRK1A
SCHEMBL5343846 0.82 CDK5 (0.48) IRAK4CDK5CDK5R1HDAC6CHEK1
SCHEMBL5345865 0.81 CDK5 (0.63) IRAK4CDK5CDK5R1TLR7HDAC6
SCHEMBL14558736 0.78 CDK5 (0.54) IRAK4CDK5CDK5R1TLR7HDAC6
SCHEMBL5788420 0.78 CDK5 (0.70) IRAK4CDK5CDK5R1TLR7HDAC6
SCHEMBL5342940 0.77 CDK5 (0.82) IRAK4CDK5CDK5R1HDAC6CHEK1
SCHEMBL5342305 0.76 CDK5 (0.77) IRAK4CDK5CDK5R1TLR7HDAC6
SCHEMBL14558375 0.76 CDK5 (0.51) IRAK4CDK5CDK5R1HDAC6ALDH1A1
SCHEMBL5345119 0.76 CDK5 (0.67) IRAK4CDK5CDK5R1TLR7HDAC6
SCHEMBL5342909 0.75 CDK5 (0.52) IRAK4CDK5CDK5R1ALDH1A1MEN1

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 12 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-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US 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
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO 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
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 IRAK4 2587/4885CDK5 64/4885CDK5R1 359/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX IRAK4 4178/4885CDK5 40/4885CDK5R1 244/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX IRAK4 2587/4885CDK5 64/4885CDK5R1 359/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX IRAK4 2587/4885CDK5 64/4885CDK5R1 359/4885

“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.