SCHEMBL12748995

SCHEMBL12748995

C#CCn1c(=O)c(C)cn(C(C[C@@H](C)O)OCCO)c1=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL13970127 1.00 KDM4E (0.33) KDM4ELMNARAB9ASMN1; SMN2GLA
SCHEMBL12748527 0.88 LMNA (0.31) LMNARAB9ASMN1; SMN2GLAADORA2B
SCHEMBL12749037 0.72 — —
SCHEMBL13970114 0.72 TYMP (0.41) LMNASMN1; SMN2BLMALDH1A1MAPK1
SCHEMBL12748997 0.69 GRIN1 (0.31) —
SCHEMBL13970113 0.66 — —
SCHEMBL24548479 0.61 TYMP (0.42) LMNASMN1; SMN2BLMALDH1A1MAPK1
SCHEMBL6555940 0.58 TYMP (0.42) LMNASMN1; SMN2BLMALDH1A1MAPK1
SCHEMBL1902451 0.58 TYMP (0.42) LMNASMN1; SMN2BLMALDH1A1MAPK1
SCHEMBL12748530 0.58 TYMP (0.42) LMNASMN1; SMN2BLMALDH1A1MAPK1

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-7928210-B2 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-04-19 — — US disclosed
US-20090016958-A1 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. 2009-01-15 — — 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-20090016958-A1 Nucleoside based proliferation imaging markers MKI67, SLC29A1, SLC29A2 KDM4E 4684/4885LMNA 999/4885RAB9A 2453/4885

“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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