SCHEMBL7117641

SCHEMBL7117641

C#Cc1ccc2c(c1)N(c1ncnc3cc(OCCCN4CCOCC4)c(C(=C)C(=O)O)cc13)CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.44
PDGFRB P09619 4/20 0.44
FLT3 P36888 2/20 0.40
CSF1R P07333 1/20 0.40
KIT P10721 1/20 0.40
AURKA O14965 3/20 0.40
AURKB Q96GD4 2/20 0.40
SRC P12931 2/20 0.40
KDR P35968 2/20 0.40
ROCK2 O75116 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
RET P07949 1/20 0.40
MET P08581 1/20 0.40
MAPT P10636 1/20 0.40
PDGFRA P16234 1/20 0.40
LTK P29376 1/20 0.40
TTK P33981 1/20 0.40
MAP2K2 P36507 1/20 0.40

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
SCHEMBL7128565 0.89 EGFR (0.45) EGFRPDGFRBFLT3CSF1RKIT
SCHEMBL7117634 0.85 EGFR (0.43) EGFRPDGFRBFLT3CSF1RKIT
SCHEMBL8524772 0.85 EGFR (0.47) EGFRPDGFRBERBB2
SCHEMBL7117699 0.77 EGFR (0.45) EGFRPDGFRBFLT3ERBB2
SCHEMBL7118722 0.76 EGFR (0.42) EGFRCSF1RKDRRET
SCHEMBL7120334 0.75 EGFR (0.57) EGFRALDH1A1ERBB2
SCHEMBL7124663 0.74 EGFR (0.41) EGFRPDGFRBCSF1RKDRALDH1A1
SCHEMBL7128562 0.74 EGFR (0.44) EGFRPDGFRBFLT3KITAURKA
SCHEMBL7126747 0.74 EGFR (0.39) EGFRFLT3CSF1RALDH1A1BTK
SCHEMBL7123160 0.73 EGFR (0.63) EGFRPDGFRBFLT3KITAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030087881-A1 Irreversible inhibitors of tyrosine kinases BRIDGES ALEXANDER JAMES (US) 2003-05-08 US claimed
US-6153617-A Irreversible bicyclic inhibitors of tyrosine kinases WARNER-LAMBERT COMPANY (US) 2000-11-28 US claimed
US-20030087881-A1 Irreversible inhibitors of tyrosine kinases BRIDGES ALEXANDER JAMES (US) 2003-05-08 US disclosed
US-6153617-A Irreversible bicyclic inhibitors of tyrosine kinases WARNER-LAMBERT COMPANY (US) 2000-11-28 US disclosed
WO-1999006396-A1 IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 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-20030087881-A1 Irreversible inhibitors of tyrosine kinases ERBB2, ERBB3, LCK EGFR 26/4885PDGFRB 182/4885FLT3 24/4885

“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.