SCHEMBL9521804

SCHEMBL9521804

OCC1CCCCN1CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.44
CHRM5 P08912 1/20 0.40
ADRA2C P18825 1/20 0.40
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
JAK2 O60674 2/20 0.39
JAK1 P23458 2/20 0.39
TYK2 P29597 1/20 0.39
CFB P00751 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TERT O14746 2/20 0.36
SPHK1 Q9NYA1 6/20 0.36
SPHK2 Q9NRA0 5/20 0.36

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
SCHEMBL25686622 0.94 CHRM5 (0.48) GBA1CHRM5ADRA2CPOLBL3MBTL1
SCHEMBL8587272 0.94 POLB (0.45) GBA1POLBL3MBTL1JAK2JAK1
SCHEMBL19616665 0.94 POLB (0.45) GBA1POLBL3MBTL1JAK2JAK1
SCHEMBL14045602 0.94 POLB (0.45) GBA1POLBL3MBTL1JAK2JAK1
SCHEMBL25686459 0.91 GBA1 (0.39) GBA1CHRM5ADRA2CPOLBL3MBTL1
SCHEMBL25686656 0.89 GBA1 (0.38) GBA1CHRM5ADRA2CPOLBL3MBTL1
SCHEMBL25686542 0.88 GBA1 (0.37) GBA1CHRM5ADRA2CPOLBL3MBTL1
SCHEMBL25686547 0.88 GBA1 (0.37) GBA1CHRM5ADRA2CPOLBL3MBTL1
SCHEMBL25686524 0.87 GBA1 (0.36) GBA1L3MBTL1JAK2JAK1TYK2
SCHEMBL25686606 0.87 GBA1 (0.40) GBA1JAK2JAK1TYK2CFB

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
EP-0490962-A4 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES 1993-03-03 EP disclosed