SCHEMBL3449276

SCHEMBL3449276

O=C(O)C=Cc1cccc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2N[C@@H]2CCOC2)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.43
ITK Q08881 5/20 0.43
TYRO3 Q06418 6/20 0.41
MERTK Q12866 3/20 0.41
SYK P43405 2/20 0.40
SELP P16109 1/20 0.40
AXL P30530 2/20 0.39
CSNK2A1 P68400 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
SCHEMBL3447857 1.00 EGFR (0.43) EGFRITKTYRO3MERTKSYK
SCHEMBL3447855 1.00 EGFR (0.43) EGFRITKTYRO3MERTKSYK
SCHEMBL13312590 1.00 EGFR (0.43) EGFRITKTYRO3MERTKSYK
SCHEMBL3449272 1.00 EGFR (0.43) EGFRITKTYRO3MERTKSYK
SCHEMBL13312565 0.90 EGFR (0.41) EGFRITKTYRO3MERTKAXL
SCHEMBL13310976 0.90 EGFR (0.41) EGFRITKTYRO3MERTKAXL
SCHEMBL3450783 0.90 EGFR (0.41) EGFRITKTYRO3MERTKAXL
SCHEMBL3450789 0.87 EGFR (0.41) EGFRITKTYRO3MERTKSYK
SCHEMBL3450787 0.87 EGFR (0.41) EGFRITKTYRO3MERTKSYK
SCHEMBL3450057 0.87 IRAK4 (0.42) EGFRITKTYRO3MERTKSYK

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD EGFR 2771/4885ITK 2005/4885TYRO3 2798/4885

“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.