SCHEMBL7764595

SCHEMBL7764595

CC(C)c1nc2c(c(C(C)(C)C)n1)CCOC2

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.31
▸ WNT3A P56704 1/20 0.31
▸ TNKS2 Q9H2K2 1/20 0.31

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
SCHEMBL7760978 0.88 WNT3A (0.37) WNT3ATNKS2
SCHEMBL7762781 0.69 ACHE (0.37) —
SCHEMBL7760964 0.67 ATM (0.32) —
SCHEMBL26020376 0.66 WNT3A (0.39) WNT3ATNKS2
SCHEMBL18711686 0.65 HTR2A (0.31) —
SCHEMBL19362369 0.64 — —
SCHEMBL7760996 0.62 — —
SCHEMBL27114737 0.62 — —
SCHEMBL26026426 0.62 TNKS2 (0.34) TNKSWNT3ATNKS2
SCHEMBL31128515 0.62 TNKS2 (0.50) TNKSWNT3ATNKS2

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-20100331305-A1 OXO-HETEROCYCLE FUSED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2010-12-30 — — 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-20100331305-A1 OXO-HETEROCYCLE FUSED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE MTOR, PIK3CA, RICTOR TNKS 234/4885WNT3A 2464/4885TNKS2 259/4885

“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.

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