SCHEMBL30729882

SCHEMBL30729882

CC(C)(C)OC(=O)Nc1ccc(Oc2ccnc([Sn](C)(C)C)c2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.46
CYP17A1 P05093 1/20 0.46
MAPK13 O15264 3/20 0.46
KDR P35968 9/20 0.45
BRAF P15056 6/20 0.45
FLT1 P17948 1/20 0.44
ABL1 P00519 1/20 0.44

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
SCHEMBL16895218 0.85 MAPK14 (0.53) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL30729902 0.85 MAPK14 (0.53) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL27096975 0.85 MAPK14 (0.47) MAPK14MAPK13KDRBRAFFLT1
SCHEMBL24037398 0.84 MAPK14 (0.48) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL2858354 0.84 MAPK14 (0.63) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL29834707 0.83 ABL1 (0.51) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL29834639 0.83 ABL1 (0.50) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL2865557 0.83 ABL1 (0.52) MAPK14CYP17A1MAPK13KDRBRAF
SCHEMBL29834780 0.82 ABL1 (0.64) MAPK14MAPK13KDRBRAFFLT1
SCHEMBL29834756 0.81 ABL1 (0.53) MAPK14CYP17A1MAPK13KDRBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059698-A1 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES ACCUTAR BIOTECHNOLOGY INC. (US) 2024-02-22 US disclosed
WO-2024026056-A2 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES ACCUTAR BIOTECHNOLOGY, INC. (US) 2024-02-01 WO 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-20240059698-A1 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES EGFR, ERBB2, ERBB3 MAPK14 701/4885CYP17A1 1500/4885MAPK13 1370/4885

“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.