SCHEMBL4127682

SCHEMBL4127682

N#Cc1cnc2ccc(C=CCCN3CCOCC3)cc2c1Nc1ccc(Cl)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 1.00
FYN P06241 2/20 0.61
MAP3K8 P41279 2/20 0.56
ABL1 P00519 1/20 0.52
EGFR P00533 1/20 0.52

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
SCHEMBL4127676 1.00 SRC (1.00) SRCFYNMAP3K8ABL1EGFR
SCHEMBL4133334 0.94 SRC (1.00) SRCFYNMAP3K8
SCHEMBL4133329 0.94 SRC (1.00) SRCFYNMAP3K8
SCHEMBL4136701 0.92 SRC (0.85) SRCFYNABL1EGFR
SCHEMBL4136696 0.92 SRC (0.85) SRCFYNABL1EGFR
SCHEMBL3221419 0.89 SRC (0.91) SRCFYNMAP3K8
SCHEMBL3221409 0.89 SRC (0.91) SRCFYNMAP3K8
SCHEMBL3228318 0.88 SRC (0.90) SRCFYN
SCHEMBL3228309 0.88 SRC (0.90) SRCFYN
SCHEMBL4117615 0.88 SRC (0.88) SRCFYN

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 3605/4885FYN 1861/4885MAP3K8 2696/4885

“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.