SCHEMBL5339286

SCHEMBL5339286

Cc1ccnc(NC(=O)Nc2csc(-c3ccncc3)n2)n1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 7/20 0.62
CDK5R1 Q15078 7/20 0.62
CCNA2 P20248 2/20 0.47
CDK2 P24941 2/20 0.47
CCNA1 P78396 2/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ROCK1 Q13464 1/20 0.45
HPGD P15428 1/20 0.44
DYRK1A Q13627 1/20 0.42
NAMPT P43490 1/20 0.42
FASN P49327 1/20 0.42
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
GPR142 Q7Z601 1/20 0.39

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
SCHEMBL5345431 0.86 CDK5 (0.78) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5341105 0.84 CDK5 (0.81) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5345140 0.82 CDK5 (0.69) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14558320 0.79 CDK5 (0.67) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL7056328 0.79 CDK5 (0.68) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14558324 0.77 CDK5 (0.65) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5338250 0.77 CDK5 (0.68) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5351920 0.77 CDK5 (0.59) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14558321 0.77 CDK5 (0.68) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5348176 0.77 CDK5 (1.00) CDK5CDK5R1CCNA2CDK2CCNA1

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 9 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
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US 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
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US 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 (3 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 CDK5 64/4885CDK5R1 359/4885CCNA2 765/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX CDK5 64/4885CDK5R1 359/4885CCNA2 765/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX CDK5 64/4885CDK5R1 359/4885CCNA2 765/4885

“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.