SCHEMBL18718082

SCHEMBL18718082

OCC1O[C@@H](OCc2ccc(O[C@H]3OC(CO)[C@@H](O)[C@H](O)C3O)cc2)C(O)[C@@H](O)[C@@H]1O

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 2/20 0.74
▸ POLB P06746 2/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ SLC5A2 P31639 2/20 0.54
▸ SLC5A1 P13866 1/20 0.53
▸ ACHE P22303 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ G6PD P11413 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ ADRA1A P35348 1/20 0.52
▸ PTGS2 P35354 1/20 0.52

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
SCHEMBL18732837 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL18718085 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL21334201 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL18732839 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL18732835 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL21334202 1.00 TYR (0.74) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL23758910 0.92 TYR (0.64) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL21334204 0.92 TYR (0.64) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL18733424 0.92 TYR (0.64) TYRPOLBNPC1RAB9ASLC5A2
SCHEMBL18718089 0.92 TYR (0.64) TYRPOLBNPC1RAB9ASLC5A2

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-20170102349-A1 ELECTROCHEMICAL METHODS AND COMPOUNDS FOR THE DETECTION OF ENZYMES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-04-13 — — 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-20170102349-A1 ELECTROCHEMICAL METHODS AND COMPOUNDS FOR THE DETECTION OF ENZYMES EPX, DNASE1, DERA TYR 646/4885POLB 101/4885NPC1 2879/4885

“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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