SCHEMBL28325239

SCHEMBL28325239

CN(C)CC1CN(C(=O)O)CCC1O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 5/20 0.34
OPRD1 P41143 4/20 0.33
HSD17B10 Q99714 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL3 Q96JM7 1/20 0.30
ALDH1A1 P00352 1/20 0.30
NPC1 O15118 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL28324291 0.91 DPP7 (0.39) OPRK1
SCHEMBL19064197 0.86 OPRK1 (0.30) OPRK1ALDH1A1
SCHEMBL15718081 0.80 GBA1 (0.32)
SCHEMBL15720653 0.78 GAA (0.33) ALDH1A1
SCHEMBL534292 0.77 GBA1 (0.30)
SCHEMBL20702387 0.77 TACR3 (0.37) OPRK1OPRD1HSD17B10MAPTALDH1A1
SCHEMBL20702384 0.77 TACR3 (0.37) OPRK1OPRD1HSD17B10MAPTALDH1A1
SCHEMBL4328443 0.77 TACR3 (0.37) OPRK1OPRD1HSD17B10MAPTALDH1A1
SCHEMBL28324290 0.75 DPP8 (0.30)
SCHEMBL3605608 0.75 MEN1 (0.41) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116751156-A Substituted 3-dialkylaminomethyl-piperidin-4-yl-benzamides and methods of making and using the same 梅比斯发现公司 2023-09-15 CN disclosed
CN-110392571-A Substituted 3-dialkylaminomethyl-piperidin-4-yl-benzamides and methods of making and using the same 梅比斯发现公司 2019-10-29 CN disclosed