SCHEMBL5911655

SCHEMBL5911655

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.86
KDR P35968 2/20 0.82
AURKA O14965 1/20 0.82
ERBB2 P04626 1/20 0.82
INSR P06213 1/20 0.82
FBP1 P09467 1/20 0.82
PDGFRB P09619 1/20 0.82
FLT4 P35916 1/20 0.82
CLK1 P49759 1/20 0.82
EPHB4 P54760 1/20 0.82
TEK Q02763 1/20 0.82
AURKB Q96GD4 1/20 0.82

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
Hydrochloric Acid SCHEMBL5911498 0.99 EGFR (0.84) EGFRKDRAURKAERBB2INSR
SCHEMBL14863005 0.95 EGFR (0.84) EGFRKDRAURKAERBB2INSR
SCHEMBL31491085 0.93 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL28520911 0.93 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL14092460 0.93 EGFR (0.92) EGFRKDRAURKAERBB2INSR
SCHEMBL30207668 0.93 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL14964773 0.93 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL15206691 0.92 EGFR (1.00) EGFRKDRAURKAERBB2INSR
SCHEMBL15206318 0.92 EGFR (1.00) EGFRKDRAURKAERBB2INSR
SCHEMBL13529196 0.92 EGFR (0.98) EGFRKDRAURKAERBB2INSR

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
WO-2021154948-A1 PRODRUGS USEFUL IN ADOPTIVE CELL THERAPY MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-08-05 WO disclosed
WO-2021154948-A1 PRODRUGS USEFUL IN ADOPTIVE CELL THERAPY MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-08-05 WO disclosed
US-20060105445-A1 Medium and method for enriching, purifying or depleting atp binding proteins from a pool of proteins GPC BIOTECH AG (DE) 2006-05-18 US disclosed
EP-1527345-A2 METHOD FOR ISOLATING ATP BINDING PROTEINS BY MEANS OF IMMOBILIZED PROTEIN INHIBITORS Axxima Pharmaceuticals AG (DE) 2005-05-04 EP disclosed
WO-2004013633-A3 METHOD FOR ISOLATING ATP BINDING PROTEINS BY MEANS OF IMMOBOLIZED PROTEIN INHIBITORS AXXIMA PHARMACEUTICALS AG (DE) 2004-10-28 WO disclosed
WO-2004013633-A2 METHOD FOR ISOLATING ATP BINDING PROTEINS BY MEANS OF IMMOBOLIZED PROTEIN INHIBITORS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-12 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-20060105445-A1 Medium and method for enriching, purifying or depleting atp binding proteins from a pool of proteins ATP5MK, ATP5ME, ATP5MG EGFR 4433/4885KDR 4212/4885AURKA 125/4885

“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.