SCHEMBL5689495

SCHEMBL5689495

CCc1cccc(NC(=O)Nc2csc(-c3ccncc3)n2)n1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 8/20 0.65
CDK5R1 Q15078 8/20 0.65
ROCK1 Q13464 1/20 0.52
CCNA2 P20248 3/20 0.46
CDK2 P24941 3/20 0.46
CCNA1 P78396 3/20 0.46
DYRK1A Q13627 1/20 0.46
SYK P43405 1/20 0.44
HPGD P15428 1/20 0.43
GPR142 Q7Z601 1/20 0.43
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
BLM P54132 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL14558392 0.92 CDK5 (0.57) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL14558329 0.91 CDK5 (0.62) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5338421 0.90 CDK5 (0.61) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5343136 0.89 CDK5 (0.66) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5341200 0.89 CDK5 (0.60) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL14558375 0.89 CDK5 (0.51) CDK5CDK5R1RAB9A
SCHEMBL5342307 0.88 CDK5 (0.62) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5344913 0.88 CDK5 (0.65) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5342467 0.86 CDK5 (0.62) CDK5CDK5R1ROCK1CCNA2CDK2
SCHEMBL5341625 0.85 CDK5 (0.58) CDK5CDK5R1ROCK1CCNA2CDK2

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
EP-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP claimed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP claimed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US claimed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 WO claimed
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-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP 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-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX CDK5 40/4885CDK5R1 244/4885ROCK1 3616/4885

“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.