SCHEMBL4170902

SCHEMBL4170902

O=C(Nc1ccc(CNc2nc(Cl)nc3cc(I)ccc23)cc1)c1ccc(F)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 20/20 0.75
TCF7L2 Q9NQB0 20/20 0.75

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
SCHEMBL4175045 0.92 CTNNB1 (0.75) CTNNB1TCF7L2
SCHEMBL4165082 0.89 CTNNB1 (0.78) CTNNB1TCF7L2
SCHEMBL4170056 0.87 CTNNB1 (0.79) CTNNB1TCF7L2
SCHEMBL4174731 0.86 CTNNB1 (0.75) CTNNB1TCF7L2
SCHEMBL4178584 0.86 CTNNB1 (1.00) CTNNB1TCF7L2
SCHEMBL4167784 0.83 CTNNB1 (0.78) CTNNB1TCF7L2
SCHEMBL4170839 0.80 CTNNB1 (0.81) CTNNB1TCF7L2
SCHEMBL4740031 0.79 CTNNB1 (0.65) CTNNB1TCF7L2
SCHEMBL4170966 0.79 CTNNB1 (0.79) CTNNB1TCF7L2
SCHEMBL4181792 0.79 CTNNB1 (0.75) CTNNB1TCF7L2

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-20090004185-A1 AMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF BETA-CATENIN/TCF-4 PATHWAY AND CANCER TREATMENT AGENTS WYETH (US) 2009-01-01 US disclosed
WO-2008086462-A2 AMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF β-CANTENIN/TCF-4 PATHWAY AND CANCER TREATMENT AGENTS WYETH (US) 2008-07-17 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-20090004185-A1 AMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF BETA-CATENIN/TCF-4 PATHWAY AND CANCER TREATMENT AGENTS TCF4, CTNNB1, TCF7 CTNNB1 2/4885TCF7L2 4/4885

“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.