SCHEMBL20436593

SCHEMBL20436593

CC(C)(CN)c1cccc(CO[Si](C)(C)C(C)(C)C)n1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
MBOAT4 Q96T53 2/20 0.31
KCNH2 Q12809 1/20 0.31
BACE1 P56817 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
SCHEMBL20416874 0.86 IRAK4 (0.34) IRAK4KCNH2BACE1
SCHEMBL20416619 0.85 IRAK4 (0.34) IRAK4KCNH2BACE1
SCHEMBL23355664 0.84 IRAK4 (0.33) IRAK4MBOAT4KCNH2BACE1
SCHEMBL20436450 0.84 KCNH2 (0.34) IRAK4MBOAT4KCNH2BACE1
SCHEMBL536722 0.81 HCRTR1 (0.41) IRAK4
SCHEMBL929267 0.81 KCNH2 (0.38) IRAK4KCNH2BACE1
SCHEMBL536792 0.80 HSD17B10 (0.33) IRAK4KCNH2BACE1
SCHEMBL5466523 0.79 KCNH2 (0.39) IRAK4KCNH2BACE1
SCHEMBL4712759 0.78 HRH1 (0.37) TAAR1IRAK4KCNH2BACE1
SCHEMBL20416670 0.78 MBOAT4 (0.47) IRAK4MBOAT4KCNH2BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399962-B2 Azolopyrimidine for the treatment of cancer-related disorders ARCUS BIOSCIENCES, INC. (US) 2019-09-03 US disclosed
US-20180215730-A1 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS ARCUS BIOSCIENCES, INC. 2018-08-02 US disclosed
US-20180215730-A1 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS ARCUS BIOSCIENCES, INC. 2018-08-02 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 (2 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-20180215730-A1 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS ADORA2A, ADORA2B, ADORA1 TAAR1 1068/4885IRAK4 759/4885MBOAT4 4806/4885
US-10399962-B2 Azolopyrimidine for the treatment of cancer-related disorders ADORA2A, ADORA2B, ADORA1 TAAR1 1068/4885IRAK4 759/4885MBOAT4 4806/4885

“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.