SCHEMBL11202160

SCHEMBL11202160

CC(=O)c1ccc2c(c1)OCC(COS(=O)(=O)c1cc(O)ccc1C)O2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
AIMP2 Q13155 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.34
MTNR1A P48039 1/20 0.34
F2 P00734 2/20 0.34

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
SCHEMBL11024643 0.86 MEN1 (0.38) ALDH1A1AIMP2MEN1KMT2ADRD2
SCHEMBL11037968 0.86 CA2 (0.48) AIMP2MEN1KMT2ADRD2DRD4
SCHEMBL11025933 0.85 MEN1 (0.48) MAPTALDH1A1SMN1; SMN2AIMP2MEN1
SCHEMBL11098301 0.83 RAB9A (0.45) MAPTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL1545676 0.82 ALDH1A1 (0.45) MAPTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11039272 0.82 CA2 (0.43) AIMP2MEN1KMT2ADRD2DRD4
SCHEMBL11027071 0.78 MEN1 (0.38) MAPTALDH1A1SMN1; SMN2AIMP2MEN1
SCHEMBL11213080 0.78 MEN1 (0.38) MAPTALDH1A1SMN1; SMN2AIMP2MEN1
SCHEMBL5992714 0.77 KDM4E (0.48) MAPTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL6956315 0.77 PRMT5 (0.47) MAPTALDH1A1SMN1; SMN2MEN1KMT2A

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-0068261-A1 N-oxacyclyl-alkylpiperidine derivatives, their preparation, pharmaceutical preparations containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1983-01-05 EP disclosed