SCHEMBL587335

SCHEMBL587335

O[C@@H]1[C@H](CF)CN(Cc2ccccc2)C[C@H]1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.50
GBA1 P04062 1/20 0.50
S1PR5 Q9H228 3/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
S1PR1 P21453 1/20 0.39
RORC P51449 1/20 0.38

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
SCHEMBL13090657 1.00 FUCA1 (0.50) FUCA1GBA1S1PR5NPC1RAB9A
SCHEMBL440211 0.88 GBA1 (0.66) FUCA1GBA1S1PR5
SCHEMBL403643 0.88 GBA1 (0.66) FUCA1GBA1S1PR5
SCHEMBL2454394 0.88 GBA1 (0.66) FUCA1GBA1S1PR5
SCHEMBL13090653 0.86 GBA1 (0.49) FUCA1GBA1S1PR5NPC1RAB9A
SCHEMBL13090652 0.85 GBA1 (0.42) FUCA1GBA1S1PR5RORC
SCHEMBL13100637 0.84 GBA1 (0.45) FUCA1GBA1S1PR5RAB9AALDH1A1
SCHEMBL8171730 0.81 FUCA1 (0.53) FUCA1S1PR5S1PR1
SCHEMBL500382 0.81 GBA1 (0.58) FUCA1GBA1S1PR5S1PR1
SCHEMBL500383 0.81 GBA1 (0.58) FUCA1GBA1S1PR5S1PR1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940766-B2 Methods for preventing and/or treating lysosomal storage disorders AMICUS THERAPEUTICS, INC. (US) 2015-01-27 US disclosed
EP-2416655-B1 METHODS FOR PREVENTING AND/OR TREATING DEGENERATIVE DISORDERS OF THE CENTRAL NERVOUS SYSTEM AMICUS THERAPEUTICS INC (US) 2014-06-25 EP disclosed
US-8304429-B2 Methods for preventing and/or treating degenerative disorders of the central nervous system AMICUS THERAPEUTICS, INC. (US) 2012-11-06 US disclosed
EP-2416656-A1 METHODS FOR PREVENTING AND/OR TREATING LYSOSOMAL STORAGE DISORDERS Amicus Therapeutics, Inc. (US) 2012-02-15 EP disclosed
EP-2416655-A1 METHODS FOR PREVENTING AND/OR TREATING DEGENERATIVE DISORDERS OF THE CENTRAL NERVOUS SYSTEM Amicus Therapeutics, Inc. (US) 2012-02-15 EP disclosed
US-20100261753-A1 METHODS FOR PREVENTING AND/OR TREATING DEGENERATIVE DISORDERS OF THE CENTRAL NERVOUS SYSTEM AMICUS THERAPEUTICS, INC. (US) 2010-10-14 US disclosed
US-20100260740-A1 METHODS FOR PREVENTING AND/OR TREATING LYSOSOMAL STORAGE DISORDERS AMICUS THERAPEUTICS, INC. (US) 2010-10-14 US disclosed
WO-2010118282-A1 METHODS FOR PREVENTING AND/OR TREATING DEGENERATIVE DISORDERS OF THE CENTRAL NERVOUS SYSTEM AMICUS THERAPEUTICS, INC. (US) 2010-10-14 WO disclosed
WO-2010118283-A1 METHODS FOR PREVENTING AND/OR TREATING LYSOSOMAL STORAGE DISORDERS AMICUS THERAPEUTICS, INC. (US) 2010-10-14 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 (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-20100261753-A1 METHODS FOR PREVENTING AND/OR TREATING DEGENERATIVE DISORDERS OF THE CENTRAL NERVOUS SYSTEM SNCA, BDNF, PARK7 FUCA1 727/4885GBA1 71/4885S1PR5 72/4885
US-20100260740-A1 METHODS FOR PREVENTING AND/OR TREATING LYSOSOMAL STORAGE DISORDERS GBA1, GAA, MAN2B1 FUCA1 156/4885GBA1 1/4885S1PR5 274/4885

“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.