SCHEMBL12523685

SCHEMBL12523685

B[C@@H]1O[C@H](COC)C(OP(=O)(O)O)C1O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMPD1 P17405 3/20 0.41
▸ ITPR3 Q14573 7/20 0.40
▸ ITPR2 Q14571 3/20 0.40
▸ ITPR1 Q14643 3/20 0.40
▸ INPP5A Q14642 1/20 0.39
▸ INPPL1 O15357 1/20 0.39
▸ AKT1 P31749 1/20 0.39

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
SCHEMBL10051004 0.89 FBP1 (0.34) SMPD1
SCHEMBL10005831 0.89 FBP1 (0.34) SMPD1
SCHEMBL21202641 0.89 FBP1 (0.34) SMPD1
SCHEMBL17754496 0.87 SMPD1 (0.34) SMPD1
SCHEMBL15964500 0.86 SMPD1 (0.31) SMPD1
SCHEMBL21474777 0.85 SMPD1 (0.30) SMPD1
SCHEMBL21202645 0.85 SMPD1 (0.30) SMPD1
SCHEMBL13912378 0.85 SMPD1 (0.30) SMPD1
SCHEMBL13830489 0.85 SMPD1 (0.30) SMPD1
SCHEMBL18892768 0.84 SMPD1 (0.30) SMPD1

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-20120238737-A1 THIOCARBON-PROTECTING GROUPS FOR RNA SYNTHESIS AGILENT TECHNOLOGIES, INC. (US) 2012-09-20 — — 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-20120238737-A1 THIOCARBON-PROTECTING GROUPS FOR RNA SYNTHESIS NSUN3, NSUN2, TRDMT1 SMPD1 2404/4885ITPR3 2038/4885ITPR2 2032/4885

“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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