SCHEMBL7474464

SCHEMBL7474464

CCCCOC(=O)N1CCC(O)(c2ccc3cccc(OC)c3c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
KDM4E B2RXH2 2/20 0.39
CHRM4 P08173 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ACACB O00763 1/20 0.37
ACACA Q13085 1/20 0.37

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
SCHEMBL5759899 0.82 ACACB (0.43) ALDH1A1KDM4EACACBACACA
SCHEMBL7471855 0.80 HDAC3 (0.39) APPOPRD1OPRK1ALDH1A1L3MBTL1
SCHEMBL16244844 0.75 CCR1 (0.49) APPOPRD1OPRK1KDM4ECHRM4
SCHEMBL8915729 0.74 OPRM1 (0.53) APPOPRD1OPRK1LMNAPOLB
SCHEMBL9311071 0.74 OPRM1 (0.57) APPOPRD1OPRK1ALDH1A1L3MBTL1
SCHEMBL7425816 0.73 SMN1; SMN2 (0.45) OPRD1OPRK1L3MBTL1CHRM4LMNA
SCHEMBL7478597 0.72 MEN1 (0.48) APPOPRD1OPRK1ALDH1A1KDM4E
SCHEMBL7422101 0.70 CHRM4 (0.45) OPRD1OPRK1L3MBTL1CHRM4LMNA
SCHEMBL9529108 0.70 APP (0.59) APPOPRD1OPRK1ALDH1A1L3MBTL1
SCHEMBL31096768 0.70 APP (0.41) APPOPRD1OPRK1ALDH1A1PSEN1

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-1244622-A1 A PROCESS FOR PREPARING TRANS-2,4-DISUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2002-10-02 EP disclosed
EP-1244623-A1 A PROCESS FOR PREPARING 4-SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2002-10-02 EP disclosed
WO-2001046143-A1 A PROCESS FOR PREPARING TRANS-2,4-DISUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2001-06-28 WO disclosed
WO-2001046147-A1 A PROCESS FOR PREPARING 4-SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY (US) 2001-06-28 WO disclosed