SCHEMBL9697554

SCHEMBL9697554

CC(O)C[C@H]1C[C@@H](CO)N(Cc2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HDAC11 Q96DB2 1/20 0.39
▸ GBA1 P04062 1/20 0.38
▸ DRD2 P14416 2/20 0.38
▸ DRD1 P21728 2/20 0.38
▸ DRD3 P35462 2/20 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
SCHEMBL9696934 1.00 SIGMAR1 (0.43) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL14256288 0.81 CCR3 (0.45) SIGMAR1MAPTHDAC11GBA1
SCHEMBL9385038 0.81 MAPT (0.44) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL20494596 0.80 MAPT (0.43) SIGMAR1MAPTHDAC11GBA1
SCHEMBL23326764 0.80 MAPT (0.43) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL29504724 0.79 GBA1 (0.45) SIGMAR1GBA1
SCHEMBL22506576 0.77 MAPT (0.53) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL9962388 0.77 MAPT (0.53) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL24938856 0.77 MAPT (0.53) SIGMAR1MAPTHDAC11GBA1DRD2
SCHEMBL9802975 0.77 MAPT (0.53) SIGMAR1MAPTHDAC11GBA1DRD2

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-1992002521-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-20 — — WO disclosed
Send feedback