SCHEMBL6706766

SCHEMBL6706766

COc1ccc(N2Cc3cnc(N(C(=O)[C@@H](N)CCc4ccccc4)c4ccccc4)nc3N(c3ccccc3)C2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.38
FGFR4 P22455 8/20 0.38
FGFR1 P11362 3/20 0.38
FGFR2 P21802 3/20 0.38
FGFR3 P22607 3/20 0.38
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
KDR P35968 2/20 0.38
FYN P06241 1/20 0.38
MAPK1 P28482 1/20 0.38
EPHB3 P54753 1/20 0.38
USP2 O75604 4/20 0.38
CYP3A4 P08684 4/20 0.38
CYP1A2 P05177 3/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.34
CYP2C9 P11712 2/20 0.34
TSHR P16473 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL4686791 0.92 FGFR4 (0.39) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL4686754 0.91 EGFR (0.38) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL14290437 0.91 EGFR (0.38) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL4689937 0.91 FGFR4 (0.40) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL6212461 0.90 EGFR (0.38) EGFRFGFR4FGFR1FGFR2FGFR3
Acetic Acid SCHEMBL4687570 0.90 EGFR (0.37) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL4690757 0.89 FGFR4 (0.39) EGFRFGFR4FGFR1FGFR2FGFR3
Acetic Acid SCHEMBL4686845 0.88 FGFR4 (0.38) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL4686694 0.85 FGFR4 (0.39) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL4686744 0.85 FGFR4 (0.45) EGFRFGFR4FGFR1FGFR2FGFR3

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-20040038995-A1 Pyrimido compounds having antiproliferative activity CHEN YI (US) 2004-02-26 US claimed

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-20040038995-A1 Pyrimido compounds having antiproliferative activity LCK, FGFR1, FGFR3 EGFR 45/4885FGFR4 5/4885FGFR1 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.