SCHEMBL4121735

SCHEMBL4121735

COc1cc(Nc2c(C#N)cnc3cc(C=CCCCCCCCCCN4CCOCC4)c(OC)cc23)c(Cl)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 1.00
ABL1 P00519 3/20 0.77
EGFR P00533 2/20 0.77
BCR P11274 1/20 0.74
ERBB2 P04626 1/20 0.65
FYN P06241 1/20 0.65
LYN P07948 1/20 0.65

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
SCHEMBL4121727 1.00 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4134289 0.99 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4134294 0.99 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4116887 0.97 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4116894 0.97 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4123793 0.94 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4123796 0.94 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4127017 0.90 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4127022 0.90 SRC (1.00) SRCABL1EGFRBCRERBB2
SCHEMBL4123935 0.87 SRC (0.98) SRCABL1EGFRBCRERBB2

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-20090099356-A1 PREPARATION OF 7-ALKENYL-3 QUINOLINECARBONITRILES VIA A PALLADIUM MEDIATED COUPLING REACTION WYETH (US) 2009-04-16 US claimed
US-20090099356-A1 PREPARATION OF 7-ALKENYL-3 QUINOLINECARBONITRILES VIA A PALLADIUM MEDIATED COUPLING REACTION WYETH (US) 2009-04-16 US 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-20090099356-A1 PREPARATION OF 7-ALKENYL-3 QUINOLINECARBONITRILES VIA A PALLADIUM MEDIATED COUPLING REACTION PARK7, UQCRB, PRMT7 SRC 3605/4885ABL1 64/4885EGFR 2351/4885

“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.