SCHEMBL18459482

SCHEMBL18459482

NC1CCC(CN2CCN(CC(=O)O)CC2)C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.38
CPB1 P15086 1/20 0.33
CPB2 Q96IY4 1/20 0.33
SLC6A9 P48067 1/20 0.32
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
KDM4E B2RXH2 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX15 P16050 1/20 0.31
ALDH1A1 P00352 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL18872667 0.90 HSD17B10 (0.40) HSD17B10SMN1; SMN2DRD2HTR2AHTR2C
SCHEMBL21253957 0.84 HSD17B10 (0.31) HSD17B10CPB1CPB2
SCHEMBL15499045 0.80 HSD17B10 (0.38) HSD17B10SLC6A9KDM4ETDP1ALDH1A1
SCHEMBL15496586 0.76 KDM4E (0.35) HSD17B10SLC6A9KDM4ETDP1ALDH1A1
Trifluoroacetic Acid SCHEMBL3908767 0.76 CACNA2D1 (0.36) CPB1CPB2ALDH1A1SIGMAR1
SCHEMBL15363579 0.76 ACHE (0.47) HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL22869300 0.76 HSD17B10 (0.40) HSD17B10KDM4ETDP1SMN1; SMN2ALDH1A1
SCHEMBL21254070 0.75 NCF1 (0.38) ALDH1A1DRD2HTR2AHTR2C
SCHEMBL963074 0.75 KDM4E (0.39) CPB1CPB2KDM4ESMN1; SMN2ALDH1A1
SCHEMBL16863956 0.75 KDM4E (0.39) CPB1CPB2KDM4ESMN1; SMN2ALDH1A1

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-2016122887-A9 OLIGOSACCHARIDE COMPOSITIONS FOR USE ANIMAL FEED AND METHODS OF PRODUCING THEREOF MIDORI USA, INC. (US) 2017-02-02 WO disclosed