SCHEMBL22668978

SCHEMBL22668978

C[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1C[C@H]1CCCN(c2cccc(C(F)(F)F)n2)C1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 17/20 0.40
▸ GRIN2B Q13224 2/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 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
SCHEMBL29447821 1.00 ACACB (0.40) ACACBGRIN2BDRD2DRD3
SCHEMBL22657533 1.00 ACACB (0.40) ACACBGRIN2BDRD2DRD3
SCHEMBL22657530 1.00 ACACB (0.40) ACACBGRIN2BDRD2DRD3
SCHEMBL29447824 1.00 ACACB (0.40) ACACBGRIN2BDRD2DRD3
SCHEMBL29447822 0.94 ACACB (0.43) ACACB
SCHEMBL22668937 0.94 ACACB (0.43) ACACB
SCHEMBL28714167 0.94 ACACB (0.43) ACACB
SCHEMBL23996555 0.88 ACACB (0.41) ACACBGRIN2B
SCHEMBL23996792 0.88 ACACB (0.41) ACACBGRIN2B
SCHEMBL23996734 0.88 ACACB (0.41) ACACBGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114174263-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2022-03-11 — — CN claimed
US-20220213058-A1 NON-LYSOSOMAL GLUCOSYLCERAMIDASE INHIBITORS AND USES THEREOF ALECTOS THERAPEUTICS INC. (CA) 2022-07-07 — — US disclosed
CN-114174263-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2022-03-11 — — CN disclosed
WO-2020229968-A1 NON-LYSOSOMAL GLUCOSYLCERAMIDASE INHIBITORS AND USES THEREOF ALECTOS THERAPEUTICS INC. (CA) 2020-11-19 — — 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-20220213058-A1 NON-LYSOSOMAL GLUCOSYLCERAMIDASE INHIBITORS AND USES THEREOF GBA1, GBA2, GAA ACACB 595/4885GRIN2B 2987/4885DRD2 4640/4885

“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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