SCHEMBL20436692

SCHEMBL20436692

CC(c1cccc(Cn2cc(-c3cc(-c4cccc(C#N)c4)nc(NC(=O)COc4ccccc4)n3)nn2)n1)C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CPT2 P23786 3/20 0.41
▸ CPT1A P50416 3/20 0.41
▸ CPT1B Q92523 1/20 0.41
▸ CDC7 O00311 2/20 0.37
▸ DAPK3 O43293 1/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ PAK4 O96013 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ CSNK1A1 P48729 1/20 0.37
▸ CDK8 P49336 1/20 0.37
▸ CLK2 P49760 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ CDK7 P50613 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ PRKX P51817 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ MELK Q14680 1/20 0.37
▸ MINK1 Q8N4C8 1/20 0.37

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
SCHEMBL20436688 0.98 CPT2 (0.39) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436689 0.93 CDC7 (0.36) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20416826 0.93 CPT2 (0.40) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436687 0.91 CDC7 (0.37) CDC7DAPK3ROCK2PAK4CDK2
SCHEMBL20416823 0.91 CPT2 (0.39) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436681 0.90 CDC7 (0.40) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436685 0.90 CDC7 (0.39) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436683 0.89 CDC7 (0.39) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL20436691 0.89 CDC7 (0.39) CPT2CPT1ACPT1BCDC7DAPK3
SCHEMBL30400816 0.89 CDC7 (0.39) CPT2CPT1ACPT1BCDC7DAPK3

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-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 (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-20180215730-A1 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS ADORA2A, ADORA2B, ADORA1 CPT2 2847/4885CPT1A 3355/4885CPT1B 3431/4885

“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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