SCHEMBL21489387

SCHEMBL21489387

Cc1cn([C@H]2C[C@H](OP(=O)(S)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3O)[C@@H](COP(=O)(S)O[C@@H]3C[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)(S)O[C@H]3C[C@H](n4ccc(N)nc4=O)O[C@@H]3COP(=O)(S)O[C@@H]3C[C@H](n4cnc5c(=O)[nH]c(N)nc54)O[C@@H]3CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 5/20 0.64
▸ TERT O14746 2/20 0.57
▸ DTYMK P23919 4/20 0.56
▸ P2RY2 P41231 2/20 0.49
▸ P2RY4 P51582 2/20 0.49
▸ P2RY6 Q15077 2/20 0.49
▸ POLB P06746 2/20 0.48
▸ ENPP1 P22413 1/20 0.44
▸ P2RY1 P47900 1/20 0.44

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
SCHEMBL26189524 1.00 F2 (0.64) F2TERTDTYMKP2RY2P2RY4
SCHEMBL21504636 1.00 F2 (0.64) F2TERTDTYMKP2RY2P2RY4
SCHEMBL26189527 1.00 F2 (0.64) F2TERTDTYMKP2RY2P2RY4
SCHEMBL21489391 0.97 F2 (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL29501178 0.97 F2 (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL30639044 0.97 F2 (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL29624021 0.97 F2 (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL14389886 0.96 DTYMK (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL29368960 0.96 DTYMK (0.60) F2TERTDTYMKP2RY2P2RY4
SCHEMBL14389953 0.96 DTYMK (0.60) F2TERTDTYMKP2RY2P2RY4

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-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 (2 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-11613554-B2 Phosphorous (V)-based reagents, processes for the preparation thereof, and their use in making stereo-defined organophoshorous (V) compounds PPIP5K2, INPP5B, PTMS F2 1434/4885TERT 3467/4885DTYMK 988/4885
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 F2 1824/4885TERT 3963/4885DTYMK 1110/4885

“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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