SCHEMBL9697758

SCHEMBL9697758

C=CCOC(=O)N1CCC[C@H]1CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.39
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SIGMAR1 Q99720 1/20 0.35
PPARG P37231 1/20 0.34
CHRM1 P11229 1/20 0.34
CASP1 P29466 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL9697879 0.87 RAB9A (0.37) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL8865107 0.85 POLB (0.54) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL8865091 0.85 POLB (0.54) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL8864772 0.80 RAB9A (0.37) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL8864765 0.80 RAB9A (0.37) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL15322317 0.80 RAB9A (0.39) RAB9APOLBL3MBTL1SIGMAR1CHRM1
SCHEMBL13648381 0.79 AKR1C3 (0.40) POLBL3MBTL1SIGMAR1ALDH1A1GAA
SCHEMBL8667871 0.79 RAB9A (0.60) RAB9AALDH1A1
SCHEMBL10683300 0.79 RAB9A (0.60) RAB9AALDH1A1
SCHEMBL8667874 0.79 RAB9A (0.60) RAB9AALDH1A1

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