SCHEMBL7905938

SCHEMBL7905938

COCCCN1c2ccnc(OC)c2CC1[C@@H]1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
ANO1 Q5XXA6 1/20 0.37
GPR119 Q8TDV5 3/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
KAT7 O95251 1/20 0.36
KAT6A Q92794 1/20 0.36
HTR6 P50406 3/20 0.35
BCHE P06276 2/20 0.35
CYP2C9 P11712 1/20 0.35
USP30 Q70CQ3 1/20 0.35
HPGDS O60760 1/20 0.34
SCN9A Q15858 1/20 0.34
FAAH O00519 1/20 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
SCHEMBL7898507 0.91 KAT7 (0.39) ALOX5APFEN1ANO1GPR119MEN1
SCHEMBL7896607 0.83 HTR6 (0.41) ANO1MEN1ALDH1A1MAPTKMT2A
SCHEMBL7898814 0.83 HTR6 (0.39) ALOX5APFEN1GPR119MEN1ALDH1A1
SCHEMBL7896805 0.82 HTR6 (0.46) ALOX5APFEN1GPR119MEN1ALDH1A1
SCHEMBL7906014 0.81 GPR119 (0.39) ANO1GPR119MEN1ALDH1A1MAPT
SCHEMBL7902460 0.79 MEN1 (0.40) ALOX5APFEN1GPR119MEN1ALDH1A1
SCHEMBL7898501 0.79 ALOX5AP (0.36) ALOX5APFEN1GPR119MEN1ALDH1A1
SCHEMBL7897488 0.78 USP30 (0.42) ANO1MEN1ALDH1A1MAPTKMT2A
SCHEMBL7899660 0.77 USP30 (0.41) ALOX5APFEN1ANO1GPR119MEN1
SCHEMBL7893412 0.75 ALOX5AP (0.39) ALOX5APFEN1GPR119USP30SCN9A

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-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 WO disclosed