SCHEMBL17082116

SCHEMBL17082116

CCOC(=O)Nc1ccc(N2CCC[C@@]3(CCN([C@H]4CC[C@H](O)CC4)C3=O)C2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
MAPT P10636 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
NR1I3 Q14994 3/20 0.38
HRH3 Q9Y5N1 2/20 0.36
PDE7A Q13946 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 4/20 0.36
CYP1A2 P05177 2/20 0.36
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 3/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL4570159 1.00 ALDH1A1 (0.39) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL17082008 0.94 SMN1; SMN2 (0.43) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL4570164 0.94 SMN1; SMN2 (0.43) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL4570214 0.92 ALDH1A1 (0.39) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL17082147 0.92 ALDH1A1 (0.39) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL17082096 0.92 PDE7A (0.38) ALDH1A1MAPTHRH3PDE7AHPGD
SCHEMBL4570162 0.92 PDE7A (0.38) ALDH1A1MAPTHRH3PDE7AHPGD
SCHEMBL17082099 0.92 SMN1; SMN2 (0.37) ALDH1A1MAPTHRH3PDE7AHPGD
SCHEMBL4570161 0.92 SMN1; SMN2 (0.37) ALDH1A1MAPTHRH3PDE7AHPGD
SCHEMBL17082101 0.92 ALDH1A1 (0.38) ALDH1A1RAB9ANPC1MAPTCASP3

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
EP-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed