SCHEMBL6395255

SCHEMBL6395255

OC[C@H]1O[C@@H](c2nc3ccc(Cl)cc3s2)[C@H](O)[C@@H]1O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 3/20 0.62
▸ SLC5A2 P31639 13/20 0.55
▸ KDM4E B2RXH2 1/20 0.44
▸ GMNN O75496 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ PMP22 Q01453 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ STAT6 P42226 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ P2RY4 P51582 1/20 0.44
▸ PYGL P06737 1/20 0.43

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
Benzoic Acid SCHEMBL6395749 0.91 P2RY2 (0.57) P2RY2SLC5A2MAPTP2RY4PYGL
SCHEMBL7048838 0.83 P2RY2 (0.60) P2RY2SLC5A2P2RY4PYGL
SCHEMBL6395173 0.83 P2RY2 (0.60) P2RY2SLC5A2P2RY4PYGL
SCHEMBL6393348 0.82 P2RY2 (0.82) P2RY2SLC5A2KDM4EMAPTSMN1; SMN2
SCHEMBL6888217 0.82 P2RY2 (0.53) P2RY2KDM4ELMNAMAPTSMN1; SMN2
SCHEMBL6888209 0.82 P2RY2 (0.53) P2RY2KDM4ELMNAMAPTSMN1; SMN2
SCHEMBL6394999 0.82 P2RY2 (0.65) P2RY2SLC5A2SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6395681 0.79 P2RY2 (0.62) P2RY2SLC5A2P2RY4PYGL
SCHEMBL6394660 0.78 P2RY2 (0.63) P2RY2SLC5A2KDM4EGMNNLMNA
SCHEMBL6393343 0.78 P2RY2 (1.00) P2RY2P2RY4

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-20050009777-A1 Non-natural carbon-linked nucleotides and dinucleotides CELLTECH R & D LIMITED (GB) 2005-01-13 — — US disclosed
EP-1409503-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES Celltech R & D Limited (GB) 2004-04-21 — — EP disclosed
WO-2003011885-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES CELLTECH R & D LIMITED (GB) 2003-02-13 — — WO 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-20050009777-A1 Non-natural carbon-linked nucleotides and dinucleotides P2RY1, P2RY11, P2RY13 P2RY2 4/4885SLC5A2 45/4885KDM4E 4877/4885

“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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