SCHEMBL4253252

SCHEMBL4253252

OCc1ccc2ncc(Cl)n2c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FYN P06241 12/20 0.40
PLK1 P53350 1/20 0.39
POLB P06746 1/20 0.37
CHEK1 O14757 2/20 0.35
CHEK2 O96017 1/20 0.35
ABL1 P00519 1/20 0.35
RECQL P46063 1/20 0.35
TYR P14679 1/20 0.35
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34

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
SCHEMBL23478476 0.82 POLB (0.41) POLBAKT1AKT2
SCHEMBL4258498 0.79 FYN (0.40) FYNPLK1CHEK1CHEK2ABL1
SCHEMBL13745284 0.79 TGFBR1 (0.40) FYNPLK1POLBCHEK1CHEK2
SCHEMBL4253156 0.79 FYN (0.41) FYNCHEK1CHEK2ABL1TYR
SCHEMBL31423373 0.73 POLB (0.41) POLBCHEK1
SCHEMBL20125127 0.72 CYP1A2 (0.53) POLB
SCHEMBL22125606 0.72 MAP3K14 (0.50) POLB
SCHEMBL21722503 0.71 ENPP2 (0.38) POLB
SCHEMBL31251397 0.70 ADORA3 (0.47) FYNCHEK1CHEK2ABL1RECQL
SCHEMBL5030840 0.68 TGFBR1 (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-08-27 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 (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-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS PIK3CD, PI4KA, PIP4K2A FYN 115/4885PLK1 624/4885POLB 3513/4885

“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.