SCHEMBL9928293

SCHEMBL9928293

CC1CCN(Cc2c[nH]c3ncnc(Nc4ccc(Cl)c(Cl)c4)c23)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 13/20 0.44
EGFR P00533 12/20 0.44
KDR P35968 4/20 0.44
LCK P06239 1/20 0.44
EPHA2 P29317 4/20 0.40
EPHB4 P54760 3/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
BRAF P15056 1/20 0.39
TNNI3K Q59H18 1/20 0.39
KDM4E B2RXH2 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
SCHEMBL9928280 0.92 EGFR (0.54) ERBB2EGFRKDRLCK
SCHEMBL9928315 0.91 EGFR (0.53) ERBB2EGFRKDRLCK
SCHEMBL9928282 0.87 EGFR (0.53) ERBB2EGFRBRAFTNNI3K
SCHEMBL9928289 0.85 AXL (0.39) ERBB2EGFRKDREPHA2DRD2
SCHEMBL9928291 0.83 EGFR (0.53) ERBB2EGFRKDRBRAFTNNI3K
SCHEMBL9928303 0.83 TTBK1 (0.45) ERBB2EGFRKDRDRD4DRD3
SCHEMBL9928279 0.83 LRRK2 (0.39) ERBB2EGFRDRD2DRD4DRD3
SCHEMBL9904005 0.83 EGFR (0.65) ERBB2EGFRKDRLCK
SCHEMBL9897094 0.82 AAK1 (0.51) ERBB2EGFRKDREPHA2EPHB4
SCHEMBL9928290 0.82 MERTK (0.39) ERBB2EGFRKDRLCKDRD2

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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2012-06-14 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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE ERBB2, EGFR, FGFR1 ERBB2 1/4885EGFR 2/4885KDR 112/4885

“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.