SCHEMBL29629218

SCHEMBL29629218

CNc1nccc(-c2sc(NC(=O)Nc3ccc(CN4CCN(C)CC4)c(C(F)(F)F)c3)nc2C)n1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 6/20 0.59
CCNC P24863 4/20 0.59
CDK1 P06493 1/20 0.54
CDK2 P24941 1/20 0.54
SRC P12931 6/20 0.54
ABL1 P00519 9/20 0.54
RET P07949 1/20 0.52
EGFR P00533 1/20 0.52
BRAF P15056 1/20 0.52
LYN P07948 2/20 0.51
BCR P11274 2/20 0.51
FGFR4 P22455 1/20 0.51
NTRK1 P04629 1/20 0.50
TEK Q02763 1/20 0.50
NTRK2 Q16620 1/20 0.50

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
SCHEMBL23068646 1.00 CDK8 (0.59) CDK8CCNCCDK1CDK2SRC
SCHEMBL23068681 0.94 RET (0.60) CDK8CCNCCDK1CDK2SRC
SCHEMBL29629238 0.94 RET (0.60) CDK8CCNCCDK1CDK2SRC
SCHEMBL29629205 0.93 CDK8 (0.58) CDK8CCNCCDK1CDK2SRC
SCHEMBL23068637 0.93 CDK8 (0.58) CDK8CCNCCDK1CDK2SRC
SCHEMBL23068639 0.93 EGFR (0.54) CDK8CCNCCDK1CDK2SRC
SCHEMBL29629215 0.93 CDK9 (0.53) CDK8CCNCCDK1CDK2SRC
SCHEMBL23068652 0.93 CDK9 (0.53) CDK8CCNCCDK1CDK2SRC
SCHEMBL29629211 0.93 EGFR (0.54) CDK8CCNCCDK1CDK2SRC
SCHEMBL23068640 0.92 CDK8 (0.51) CDK8CCNCCDK1CDK2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111757881-B 5- (Pyrimidin-4-yl) thiazol-2-yl urea derivatives as therapeutic agents 澳升医药公司 2024-05-07 CN claimed
US-20230092876-A1 5-(PYRIMIDIN-4-YL)THIAZOL-2-YL UREA DERIVATIVES AS THERAPEUTIC AGENTS AUCENTRA THERAPEUTICS PTY LTD (AU) 2023-03-23 US disclosed
US-11325900-B2 5-(pyrimidin-4-yl)thiazol-2-yl urea derivatives as therapeutic agents AUCENTRA HOLDINGS PTY LTD (AU) 2022-05-10 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 (2 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-20230092876-A1 5-(PYRIMIDIN-4-YL)THIAZOL-2-YL UREA DERIVATIVES AS THERAPEUTIC AGENTS CDK8, CDK18, CDK9 CDK8 1/4885CCNC 38/4885CDK1 17/4885
US-11325900-B2 5-(pyrimidin-4-yl)thiazol-2-yl urea derivatives as therapeutic agents CDK8, CDK18, CDK9 CDK8 1/4885CCNC 38/4885CDK1 17/4885

“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.