SCHEMBL21982934

SCHEMBL21982934

CC(C)(C)c1cc(C2CC2)cc2[nH]c(=O)[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
YTHDF3 Q7Z739 1/20 0.35
YTHDF1 Q9BYJ9 1/20 0.35
YTHDF2 Q9Y5A9 1/20 0.35
GRIA1 P42261 1/20 0.30
CACNG8 Q8WXS5 1/20 0.30

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
SCHEMBL21982937 0.73 GRIN2D (0.42) GRIA1CACNG8
SCHEMBL22169013 0.71 KIF11 (0.40)
SCHEMBL19677848 0.66 CA2 (0.54)
SCHEMBL22928150 0.66 KIF11 (0.53) GRIA1CACNG8
SCHEMBL13765834 0.65 GRIA1 (0.33) GRIA1CACNG8
SCHEMBL19677843 0.62 CA2 (0.48)
SCHEMBL24007751 0.62 BRD4 (0.33) YTHDF2
SCHEMBL6193229 0.61 SMYD3 (0.43) YTHDF3YTHDF1YTHDF2GRIA1CACNG8
SCHEMBL802736 0.61 ESR2 (0.48)
SCHEMBL23220291 0.61 ALDH1A1 (0.51)

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-10647703-B2 Inhibitors of KRAS G12C mutant proteins ARAXES PHARMA LLC (US) 2020-05-12 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-10647703-B2 Inhibitors of KRAS G12C mutant proteins KRAS, NRAS, G3BP1 YTHDF3 4016/4885YTHDF1 3539/4885YTHDF2 4147/4885

“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.