SCHEMBL13625268

SCHEMBL13625268

CC1CCC(CNCCCCCCCCCCCCCCCCCCCCO)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.50
GNAI3 P08754 2/20 0.46
GNAO1 P09471 2/20 0.46
GNAI1 P63096 2/20 0.46
EPHX1 P07099 1/20 0.34
DPP4 P27487 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
LMNA P02545 2/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL22323199 0.88 SAT1 (0.56) SAT1GNAI3GNAO1GNAI1EPHX1
SCHEMBL13624910 0.84 GNAI3 (0.49) SAT1GNAI3GNAO1GNAI1EPHX1
SCHEMBL3427404 0.81
SCHEMBL11067343 0.80 EPHX1 (0.47) SAT1GNAI3GNAO1GNAI1EPHX1
SCHEMBL7202980 0.79 SAT1 (0.67) SAT1GNAI3GNAO1GNAI1CA12
SCHEMBL7206783 0.79 SAT1 (0.67) SAT1GNAI3GNAO1GNAI1CA12
SCHEMBL7201201 0.79 SAT1 (0.67) SAT1GNAI3GNAO1GNAI1CA12
SCHEMBL7207732 0.79 SAT1 (0.67) SAT1GNAI3GNAO1GNAI1CA12
SCHEMBL7199454 0.79 SAT1 (0.67) SAT1GNAI3GNAO1GNAI1CA12
SCHEMBL11064531 0.78 SAT1 (0.45) SAT1GNAI3GNAO1GNAI1EPHX1

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-2009138511-A1 LONG-ACTING Y2 AND/OR Y4 RECEPTOR AGONISTS NOVO NORDISK A/S (DK) 2009-11-19 WO disclosed