SCHEMBL21188583

SCHEMBL21188583

CC(C)C1CNC[C@H](O)C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.34
MAN1B1 Q9UKM7 1/20 0.33
FUCA1 P04066 4/20 0.31
GLA P06280 2/20 0.31
GAA P10253 1/20 0.31
GLB1 P16278 1/20 0.31

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
SCHEMBL18663800 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL19079551 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL19079554 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL19079553 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL18663513 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL23583924 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL19079552 1.00 GBA1 (0.34) GBA1MAN1B1FUCA1GLAGAA
SCHEMBL21385654 0.84 GBA1 (0.42) GBA1MAN1B1
SCHEMBL12778997 0.84 GBA1 (0.42) GBA1MAN1B1
SCHEMBL18663731 0.84 GBA1 (0.42) GBA1MAN1B1

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
WO-2019143719-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed