SCHEMBL10101578

SCHEMBL10101578

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ADK P55263 1/20 0.36
▸ HSPA8 P11142 1/20 0.36
▸ CSNK2A2 P19784 4/20 0.35
▸ CSNK2A1 P68400 4/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CCNB1 P14635 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CCNA1 P78396 1/20 0.35
▸ HIF1A Q16665 1/20 0.34
▸ PIK3CD O00329 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ACVRL1 P37023 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL10101575 0.92 CSNK2A2 (0.34) CSNK2A2CSNK2A1HIF1ASMN1; SMN2ACVRL1
SCHEMBL10101583 0.90 NPC1 (0.40) MAPTHSPA8CSNK2A2CSNK2A1HIF1A
SCHEMBL10101512 0.89 PIK3CD (0.34) ADKHSPA8CSNK2A2CSNK2A1PIK3CD
SCHEMBL10101582 0.89 PIK3CD (0.34) ADKHSPA8CSNK2A2CSNK2A1PIK3CD
SCHEMBL10101568 0.84 PIK3CD (0.36) HIF1APIK3CDSMN1; SMN2ACVRL1DPP4
SCHEMBL10101558 0.84 ADK (0.35) ADKCDK1CDK2HIF1APIK3CD
SCHEMBL10101562 0.84 ACVRL1 (0.40) HIF1ASMN1; SMN2ACVRL1DPP4MEN1
SCHEMBL10100350 0.82 HIF1A (0.41) KDM4ETDP1TP53MAPTADK
SCHEMBL10101588 0.82 HIF1A (0.35) ADKCDK1CDK2HIF1ASMN1; SMN2
SCHEMBL10101611 0.82 DOT1L (0.40) ADKHSPA8HIF1APIK3CDSMN1; SMN2

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 KDM4E 4293/4885TDP1 314/4885TP53 372/4885

“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.

Send feedback