SCHEMBL24444066

SCHEMBL24444066

N#CCCOP(O)(=S)OC[C@H]1C[C@@H](n2cnc3c(=O)[nH]cnc32)[C@@H]1CO

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ALB P02768 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ P2RX3 P56373 1/20 0.41
▸ HPRT1 P00492 11/20 0.41
▸ ADORA3 P0DMS8 3/20 0.39
▸ TYMP P19971 2/20 0.37
▸ PNP P00491 1/20 0.35

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
SCHEMBL21263957 0.87 ALDH1A1 (0.41) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL20691935 0.84 P2RX3 (0.42) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL20691298 0.83 AHCY (0.37) TYMP
SCHEMBL22349203 0.79 STING1 (0.38) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL8537379 0.78 ALDH1A1 (0.56) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL8338176 0.78 ALDH1A1 (0.56) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL20692221 0.75 P2RX3 (0.36) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL20691336 0.75 RNASEL (0.42) ALDH1A1P2RX3
SCHEMBL9310418 0.71 ALDH1A1 (0.58) ALDH1A1LMNAALBMAPK1P2RX3
SCHEMBL9309087 0.71 ALDH1A1 (0.58) ALDH1A1LMNAALBMAPK1P2RX3

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-11339185-B2 Cyclic dinucleotides as anticancer agents BRISTOL-MYERS SQUIBB COMPANY (US) 2022-05-24 — — 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-11339185-B2 Cyclic dinucleotides as anticancer agents DPYD, NTPCR, CD38 ALDH1A1 1444/4885LMNA 1855/4885ALB 4882/4885

“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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