SCHEMBL23939418

SCHEMBL23939418

Cc1c(F)cn2ncnc(O)c12

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.37
EGFR P00533 3/20 0.37
MAPK14 Q16539 2/20 0.32
MET P08581 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL23096263 0.81 KDR (0.33) KDREGFRKDM4EALDH1A1MAPK1
SCHEMBL24392406 0.79 KDR (0.37) KDREGFRMAPK14
SCHEMBL24393356 0.79 KDR (0.38) KDREGFRMAPK14
SCHEMBL23939422 0.79 EGFR (0.35) KDREGFRKDM4EALDH1A1MAPK1
SCHEMBL23096261 0.76 ALDH1A1 (0.33) KDREGFRALDH1A1
SCHEMBL24392514 0.75 KDR (0.35) KDREGFR
SCHEMBL1228109 0.70 MAPT (0.45) EGFRMAPK14MAPK1
SCHEMBL4811354 0.70 MAPK14 (0.45) KDRMAPK14
SCHEMBL1227597 0.69 MAP2K1 (0.55) KDREGFRMAPK14
SCHEMBL12537638 0.67 EGFR (0.52) KDREGFRMET

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-12030897-B2 Pyrrolo[2,1-f][1,2,4]triazine derivatives serving as selective HER2 inhibitors and application thereof MEDSHINE DISCOVERY INC. (CN) 2024-07-09 US disclosed
US-12030897-B2 Pyrrolo[2,1-f][1,2,4]triazine derivatives serving as selective HER2 inhibitors and application thereof MEDSHINE DISCOVERY INC. (CN) 2024-07-09 US disclosed
US-20210323979-A1 PYRROLO[2,1-F][1,2,4]TRIAZINE DERIVATIVES SERVING AS SELECTIVE HER2 INHIBITORS AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2021-10-21 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 (2 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-12030897-B2 Pyrrolo[2,1-f][1,2,4]triazine derivatives serving as selective HER2 inhibitors and application thereof ERBB2, EGFR, ERBB3 KDR 78/4885EGFR 2/4885MAPK14 469/4885
US-20210323979-A1 PYRROLO[2,1-F][1,2,4]TRIAZINE DERIVATIVES SERVING AS SELECTIVE HER2 INHIBITORS AND APPLICATION THEREOF ERBB2, EGFR, ERBB3 KDR 78/4885EGFR 2/4885MAPK14 469/4885

“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.