SCHEMBL7637709

SCHEMBL7637709

O[C@H]1[C@H](O)[C@H](O)CN(Cc2ccccc2)C[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 1.00
GBA1 P04062 6/20 0.75
ALDH1A1 P00352 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
S1PR1 P21453 1/20 0.53
S1PR5 Q9H228 1/20 0.53
SLC18A3 Q16572 1/20 0.50

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
SCHEMBL7637770 1.00 FUCA1 (1.00) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL1860555 1.00 FUCA1 (1.00) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL15599205 0.96 FUCA1 (0.92) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL15599027 0.96 FUCA1 (0.92) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL15599028 0.96 FUCA1 (0.92) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL17181666 0.96 FUCA1 (0.92) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL5155562 0.92 FUCA1 (0.85) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL71063 0.92 FUCA1 (0.85) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL20017877 0.92 FUCA1 (0.85) FUCA1GBA1ALDH1A1SIGMAR1S1PR1
SCHEMBL562632 0.92 FUCA1 (0.85) FUCA1GBA1ALDH1A1SIGMAR1S1PR1

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-20070197471-A1 Treatment of degenerative cartilage conditions in a mammal with Glycosidasc Inhibitors OPTIMER PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-20070197471-A1 Treatment of degenerative cartilage conditions in a mammal with Glycosidasc Inhibitors OPTIMER PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-6462193-B1 ADDING 3-AZIDO-2-HYDROXYPROPANALDEHYDE WITH DIHYDROXYACETONE PHOSPHATE USING AN ALDOLASE, HYDROLYZING THE INTERMEDIATE WITH ACID PHOSPHATASE, ISOMERIZING USING AN ISOMERASE, CYCLIZING USING REDUCTIVE AMINATION TO PRODUCE TETRAHYDROXYAZEPINE THE SCRIPPS RESEARCH INSTITUTE 2002-10-08 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-20070197471-A1 Treatment of degenerative cartilage conditions in a mammal with Glycosidasc Inhibitors MMP1, MMP13, MMP3 FUCA1 6/4885GBA1 51/4885ALDH1A1 830/4885

“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.