SCHEMBL24167367

SCHEMBL24167367

Cc1ccc(Oc2cc(F)c(Nc3ncnc4ccc(N)cc34)cc2C)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.48
ERBB2 P04626 4/20 0.48
ERBB3 P21860 1/20 0.48
ERBB4 Q15303 1/20 0.48
RAF1 P04049 4/20 0.46
BRAF P15056 4/20 0.46
GCK P35557 2/20 0.46
FECH P22830 1/20 0.45
CDK8 P49336 1/20 0.45
MAP2K5 Q13163 1/20 0.45
CDK19 Q9BWU1 1/20 0.45
MKNK2 Q9HBH9 1/20 0.45
DYRK1A Q13627 1/20 0.44
RET P07949 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
KIF5B P33176 1/20 0.42
KDR P35968 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL24167901 0.85 EGFR (0.46) EGFRERBB2ERBB3ERBB4RAF1
SCHEMBL24167954 0.84 ALDH1A1 (0.56) EGFRERBB2ERBB3ERBB4RAF1
SCHEMBL4866251 0.84 EGFR (0.67) EGFRERBB2ERBB3ERBB4FECH
SCHEMBL24167266 0.80 EGFR (0.57) EGFRERBB2ERBB3ERBB4KDR
SCHEMBL24167639 0.80 ERBB2 (0.56) EGFRERBB2RAF1BRAFFECH
SCHEMBL2990203 0.78 EGFR (0.57) EGFRERBB2ERBB3ERBB4FECH
SCHEMBL24167366 0.77 EGFR (0.48) EGFRERBB2ERBB3ERBB4FECH
SCHEMBL26019038 0.77 ERBB2 (0.38) EGFRERBB2RAF1BRAFFECH
SCHEMBL24167349 0.76 EGFR (0.52) EGFRERBB2ERBB3ERBB4FECH
SCHEMBL24832693 0.75 ERBB2 (0.68) EGFRERBB2ERBB3ERBB4FECH

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
US-20230265098-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN INC. 2023-08-24 US disclosed
US-20230265098-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN INC. 2023-08-24 US disclosed
WO-2022006386-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-01-06 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-20230265098-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ERBB2, ERBB3, CHEK2 EGFR 6/4885ERBB2 1/4885ERBB3 2/4885

“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.