SCHEMBL22473809

SCHEMBL22473809

CC(C)C(=O)CCNc1nccc(-c2cn(CC(F)F)nc2-c2cnc3[nH]ccc3c2)n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 8/20 0.41
BRAF P15056 8/20 0.40
PIK3C3 Q8NEB9 1/20 0.35
MAP3K14 Q99558 3/20 0.35

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
SCHEMBL22360762 0.92 ACVR1 (0.42) ACVR1BRAFPIK3C3MAP3K14
SCHEMBL20574013 0.91 ACVR1 (0.42) ACVR1BRAFPIK3C3MAP3K14
SCHEMBL2960546 0.87 BRAF (0.53) ACVR1BRAFMAP3K14
SCHEMBL2639988 0.84 BRAF (0.44) ACVR1BRAFMAP3K14
SCHEMBL29352906 0.84 BRAF (0.44) ACVR1BRAFMAP3K14
SCHEMBL20574042 0.82 ACVR1 (0.37) ACVR1BRAF
SCHEMBL22473738 0.81 BRAF (0.44) ACVR1BRAFMAP3K14
SCHEMBL22360766 0.81 ACVR1 (0.41) ACVR1BRAFPIK3C3MAP3K14
SCHEMBL22360768 0.81 ACVR1 (0.42) ACVR1BRAFPIK3C3MAP3K14
SCHEMBL20574048 0.81 ACVR1 (0.36) ACVR1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787443-B2 RAF-degrading conjugate compounds ZAMBONI CHEM SOLUTIONS INC. (CA) 2020-09-29 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-10787443-B2 RAF-degrading conjugate compounds BRAF, RAF1, ARAF ACVR1 2798/4885BRAF 1/4885PIK3C3 341/4885

“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.