SCHEMBL3884015

SCHEMBL3884015

COc1c(C(=O)O)cnc2ccc(/C=S3/CC(=O)N=C3N[C@@H]3C[C@H]3c3ccccc3)cc12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.40
SRC P12931 7/20 0.40
KDR P35968 5/20 0.37
FLT1 P17948 5/20 0.37
SYK P43405 5/20 0.37
ABL1 P00519 4/20 0.37
NUDT1 P36639 1/20 0.32
PDE4B Q07343 1/20 0.32
KDM1A O60341 2/20 0.31
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31
EPHX2 P34913 1/20 0.30

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
SCHEMBL3883318 0.95 EGFR (0.39) EGFRSRCKDRFLT1SYK
SCHEMBL3880153 0.94 EGFR (0.39) EGFRSRCKDRFLT1SYK
SCHEMBL3881229 0.93 EGFR (0.38) EGFRSRCKDRFLT1SYK
SCHEMBL3948070 0.92 EGFR (0.35) EGFRSRCKDRFLT1SYK
SCHEMBL3880451 0.89 EGFR (0.39) EGFRSRCKDRFLT1SYK
SCHEMBL3882523 0.89 EGFR (0.39) EGFRSRCKDRFLT1SYK
SCHEMBL3880080 0.88 EGFR (0.38) EGFRSRCKDRFLT1SYK
SCHEMBL3884236 0.87 EGFR (0.38) EGFRSRCKDRFLT1SYK
SCHEMBL3883356 0.86 MAPT (0.38) EGFRSRC
SCHEMBL3886602 0.83 EGFR (0.36) EGFRSRCKDRFLT1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771443-B1 QUINOLINE THIAZOLINONES WITH CDK-1 ANTIPROLIFERATIVE ACTIVITY HOFFMANN LA ROCHE (CH) 2009-01-07 EP claimed
US-7250515-B2 Thiazolinone 3,4-disubstituted quinolines HOFFMAN-LA ROCHE INC. (US) 2007-07-31 US claimed
US-20060004046-A1 Thiazolinone 3,4-disubstituted quinolines CHEN LI 2006-01-05 US claimed
EP-1771443-B1 QUINOLINE THIAZOLINONES WITH CDK-1 ANTIPROLIFERATIVE ACTIVITY HOFFMANN LA ROCHE (CH) 2009-01-07 EP disclosed
US-7250515-B2 Thiazolinone 3,4-disubstituted quinolines HOFFMAN-LA ROCHE INC. (US) 2007-07-31 US disclosed
US-20060004046-A1 Thiazolinone 3,4-disubstituted quinolines CHEN LI 2006-01-05 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-20060004046-A1 Thiazolinone 3,4-disubstituted quinolines CDK1, CDK17, CDK14 EGFR 1881/4885SRC 1014/4885KDR 2272/4885

“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.