SCHEMBL8333129

SCHEMBL8333129

CCCNC(=O)C1(CC)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
SPHK1 Q9NYA1 6/20 0.38
EPHX1 P07099 2/20 0.38
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MCL1 Q07820 1/20 0.36
KDM4E B2RXH2 1/20 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
SCHEMBL16416206 0.90 CETP (0.45) POLBKMT2AALDH1A1MMP1MMP2
SCHEMBL619155 0.85 POLB (0.41) POLBKMT2AALDH1A1MEN1MMP1
SCHEMBL12334722 0.83 SPHK1 (0.36) POLBKMT2AALDH1A1MEN1SPHK1
SCHEMBL26081877 0.82 HTT (0.41) KMT2AALDH1A1MEN1MMP1MMP2
SCHEMBL12335981 0.82 KDM4E (0.47) L3MBTL1KDM4E
SCHEMBL26343577 0.80 HTR1A (0.39) POLBKMT2AALDH1A1MEN1MMP1
SCHEMBL24654081 0.77 CYP2C19 (0.37) KMT2AMEN1SPHK1EPHX1
SCHEMBL29331994 0.77 SPHK1 (0.51) POLBKMT2AALDH1A1MEN1MMP1
SCHEMBL12334718 0.77 MME (0.56) POLBALDH1A1MAPT
SCHEMBL12334723 0.76 MME (0.40) POLBSPHK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868182-A4 PROCESS FOR PRODUCTION OF PIPERIDINE DERIVATIVES ALBANY MOLECULAR RES INC (US) 1999-04-07 EP disclosed
EP-0868182-A1 PROCESS FOR PRODUCTION OF PIPERIDINE DERIVATIVES ALBANY MOLECULAR RESEARCH, INC. (US) 1998-10-07 EP disclosed
WO-1997023213-A1 PROCESS FOR PRODUCTION OF PIPERIDINE DERIVATIVES ALBANY MOLECULAR RESEARCH, INC. (US) 1997-07-03 WO disclosed
WO-1997009983-A1 PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PRODUCTION ALBANY MOLECULAR RESEARCH, INC. (US) 1997-03-20 WO disclosed