SCHEMBL7126655

SCHEMBL7126655

C=C(C(=O)O)c1ccc2c(Nc3ccc4[nH]cnc4c3)ncnc2c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.46
EPHB2 P29323 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46
EGFR P00533 9/20 0.42
ERBB2 P04626 2/20 0.42
SUV39H1 O43463 3/20 0.41
PRMT1 Q99873 3/20 0.41
BRAF P15056 2/20 0.40
ERBB4 Q15303 1/20 0.40
TOP2A P11388 1/20 0.40
RAF1 P04049 1/20 0.40
RIPK2 O43353 1/20 0.40
CSF1R P07333 2/20 0.39
SMYD3 Q9H7B4 1/20 0.39
TTBK1 Q5TCY1 1/20 0.39
TTBK2 Q6IQ55 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
SCHEMBL7126665 0.92 RAF1 (0.48) FBP1EPHB2MKNK1EGFRSUV39H1
SCHEMBL7128555 0.92 EGFR (0.47) FBP1EPHB2MKNK1EGFRERBB2
SCHEMBL7127858 0.84 EGFR (0.58) EGFRERBB2
SCHEMBL7128560 0.84 RAF1 (0.54) FBP1EPHB2MKNK1EGFRERBB2
SCHEMBL7126660 0.78 FBP1 (0.45) FBP1EPHB2MKNK1EGFRERBB2
SCHEMBL7241072 0.77 KDR (0.61) EPHB2EGFRERBB2ERBB4RIPK2
SCHEMBL7127189 0.76 EGFR (0.66) EGFRERBB2ERBB4
SCHEMBL7237990 0.74 EGFR (0.44) EGFRERBB2SUV39H1PRMT1TTBK1
SCHEMBL7241721 0.73 EGFR (0.64) EGFRERBB2ERBB4CSF1RTTBK1
SCHEMBL7128556 0.72 EGFR (0.47) FBP1EPHB2MKNK1EGFRERBB2

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 6 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
WO-1999006396-A1 IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO 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 FBP1 4232/4885EPHB2 320/4885MKNK1 196/4885

“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.