SCHEMBL21489368

SCHEMBL21489368

CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H]1CO[P]1(S)SCCS1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 6/20 0.51
▸ NT5E P21589 1/20 0.49
▸ FUT5 Q11128 1/20 0.47
▸ GSK3A P49840 2/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ MAPK14 Q16539 2/20 0.47
▸ TGM2 P21980 1/20 0.47
▸ PNP P00491 1/20 0.46
▸ STING1 Q86WV6 3/20 0.45
▸ PDE3B Q13370 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ KRAS P01116 4/20 0.45

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
SCHEMBL21489171 0.92 STING1 (0.47) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21489259 0.92 IMPDH2 (0.42) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21473293 0.91 HINT1 (0.51) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21489365 0.91 HINT1 (0.51) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21489200 0.89 HINT1 (0.51) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL29479240 0.85 HINT1 (0.57) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21489358 0.84 STING1 (0.42) HINT1NT5EFUT5STING1
SCHEMBL21489386 0.84 POLB (0.48) HINT1NT5EFUT5STING1PDE3B
SCHEMBL21474251 0.83 HINT1 (0.51) HINT1NT5EFUT5GSK3ARPS6KA3
SCHEMBL21489169 0.83 STING1 (0.51) HINT1NT5EFUT5GSK3ARPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE 2023-08-03 — — US disclosed
US-11613554-B2 Phosphorous (V)-based reagents, processes for the preparation thereof, and their use in making stereo-defined organophoshorous (V) compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-03-28 — — US disclosed
US-20190322694-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE 2019-10-24 — — 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 (3 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-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, INPP5B, PTMS HINT1 1295/4885NT5E 472/4885FUT5 4001/4885
US-11613554-B2 Phosphorous (V)-based reagents, processes for the preparation thereof, and their use in making stereo-defined organophoshorous (V) compounds PPIP5K2, INPP5B, PTMS HINT1 1295/4885NT5E 472/4885FUT5 4001/4885
US-20190322694-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, INPP5B, PTMS HINT1 949/4885NT5E 379/4885FUT5 3743/4885

“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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