SCHEMBL10101508

SCHEMBL10101508

C[C@@H]1[C@@H](CO)O[C@@H](c2cc(C(N)=O)c3c(N)ncnn23)C1(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 6/20 0.37
▸ CSNK2A2 P19784 8/20 0.34
▸ CSNK2A1 P68400 8/20 0.34
▸ ACVRL1 P37023 2/20 0.33
▸ HSPA8 P11142 1/20 0.32
▸ ADK P55263 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ CCNB1 P14635 1/20 0.31
▸ CCNA2 P20248 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ CCNA1 P78396 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
SCHEMBL10101516 0.92 CSNK2A2 (0.34) PIK3CDCSNK2A2CSNK2A1ACVRL1
SCHEMBL10101509 0.90 PIK3CD (0.36) PIK3CDCSNK2A2CSNK2A1ACVRL1HSPA8
SCHEMBL10101520 0.90 NPC1 (0.36) PIK3CDCSNK2A2CSNK2A1ACVRL1
SCHEMBL10101511 0.89 PIK3CD (0.35) PIK3CDCSNK2A2CSNK2A1ACVRL1HSPA8
SCHEMBL645943 0.86 ADORA2A (0.41) PIK3CDCSNK2A2CSNK2A1ACVRL1HSPA8
SCHEMBL10101487 0.85 ACVRL1 (0.35) PIK3CDACVRL1ADKCDK1CDK2
SCHEMBL10101497 0.85 ACVRL1 (0.38) PIK3CDACVRL1
SCHEMBL10101503 0.85 PIK3CD (0.38) PIK3CDACVRL1
SCHEMBL10101517 0.82 CSNK2A2 (0.33) PIK3CDCSNK2A2CSNK2A1ACVRL1
SCHEMBL10101546 0.82 ADK (0.36) PIK3CDACVRL1ADK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119607-B2 Bicyclic nucleosides and nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-02-21 — — US disclosed
US-20100035836-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENTIFIC MANAGEMENT (AU) 2010-02-11 — — 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-20100035836-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, PNP, DCTD PIK3CD 636/4885CSNK2A2 4716/4885CSNK2A1 4695/4885

“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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