SCHEMBL22338174

SCHEMBL22338174

COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCOC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.80
FBP1 P09467 2/20 0.78
ERBB2 P04626 3/20 0.78
KDR P35968 2/20 0.78
AURKA O14965 1/20 0.78
INSR P06213 1/20 0.78
PDGFRB P09619 1/20 0.78
FLT4 P35916 1/20 0.78
CLK1 P49759 1/20 0.78
EPHB4 P54760 1/20 0.78
TEK Q02763 1/20 0.78
AURKB Q96GD4 1/20 0.78
HDAC3 O15379 1/20 0.77
HDAC4 P56524 1/20 0.77
HDAC1 Q13547 1/20 0.77
HDAC7 Q8WUI4 1/20 0.77
HDAC2 Q92769 1/20 0.77
HDAC10 Q969S8 1/20 0.77
HDAC11 Q96DB2 1/20 0.77
HDAC8 Q9BY41 1/20 0.77

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
SCHEMBL22336875 0.95 EGFR (0.87) EGFRFBP1ERBB2KDRAURKA
SCHEMBL24535320 0.94 EGFR (0.72) EGFRFBP1ERBB2KDRAURKA
SCHEMBL25083284 0.93 EGFR (0.71) EGFRFBP1ERBB2KDRAURKA
SCHEMBL6994526 0.92 EGFR (0.69) EGFRFBP1ERBB2KDRAURKA
SCHEMBL8211574 0.90 HDAC3 (0.89) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL10118455 0.90 HDAC3 (0.83) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL30520472 0.89 EGFR (0.87) EGFRFBP1ERBB2KDRAURKA
SCHEMBL13524614 0.89 EGFR (0.87) EGFRFBP1ERBB2KDRAURKA
SCHEMBL8205069 0.89 HDAC3 (0.93) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL12694355 0.89 KDR (0.71) EGFRFBP1ERBB2KDRHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-03-02 US disclosed
WO-2020163594-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 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-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF PMP22, MAG, FABP7 EGFR 3726/4885FBP1 1888/4885ERBB2 3924/4885

“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.