SCHEMBL8303792

SCHEMBL8303792

CCNC(=O)[C@H]1CC(C)CCN1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
FKBP5 Q13451 1/20 0.34
KMT2A Q03164 1/20 0.34
BCHE P06276 1/20 0.33
DPP4 P27487 1/20 0.33
F2 P00734 4/20 0.33
NPSR1 Q6W5P4 1/20 0.32
HTT P42858 1/20 0.31
KDM4E B2RXH2 2/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
CYP3A4 P08684 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL8303790 1.00 ALDH1A1 (0.35) ALDH1A1FKBP5KMT2ABCHEDPP4
SCHEMBL9232966 0.81 KDM4E (0.35) ALDH1A1F2KDM4EPOLBNPC1
SCHEMBL9232970 0.81 KDM4E (0.35) ALDH1A1F2KDM4EPOLBNPC1
SCHEMBL27532358 0.80 SMN1; SMN2 (0.47) ALDH1A1KMT2ANPSR1POLBNPC1
SCHEMBL617286 0.79 NPSR1 (0.48) ALDH1A1FKBP5KMT2ABCHEDPP4
SCHEMBL2835654 0.79 NPSR1 (0.48) ALDH1A1FKBP5KMT2ABCHEDPP4
SCHEMBL8300090 0.78 EPHX1 (0.36) ALDH1A1KMT2ADPP4HTTPOLB
SCHEMBL8300088 0.78 EPHX1 (0.36) ALDH1A1KMT2ADPP4HTTPOLB
SCHEMBL8539717 0.78 ATM (0.44) ALDH1A1NPC1
SCHEMBL8539711 0.78 ATM (0.44) ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614986-B1 Enzymatic racemate cleavage of 2-pipéridine alkylcarboxylates SYNTHELABO (FR) 1999-07-21 EP disclosed
EP-0565396-B1 1-[2-(arylsulfonylamino)-1-oxoethyl]piperidine derivatives, their preparation and use in therapy SYNTHELABO (FR) 1998-01-07 EP disclosed
EP-0614986-A1 Enzymatic racemate cleavage of 2-pipéridine alkylcarboxylates and their use as synthesis intermediates SYNTHELABO (FR) 1994-09-14 EP disclosed