SCHEMBL17082147

SCHEMBL17082147

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 2/20 0.38
RECQL P46063 1/20 0.38
MAPT P10636 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
CYP2C19 P33261 2/20 0.38
HPGD P15428 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR1I3 Q14994 1/20 0.38
PDE7A Q13946 1/20 0.37
LMNA P02545 1/20 0.37
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37

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
SCHEMBL4570214 1.00 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AKDM4ERECQL
SCHEMBL4570215 0.93 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9AKDM4ERECQL
SCHEMBL17082193 0.93 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9AKDM4ERECQL
SCHEMBL4570159 0.92 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL17082116 0.92 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL4570213 0.91 KDM4E (0.41) ALDH1A1NPC1RAB9AKDM4ERECQL
SCHEMBL4570135 0.91 ALDH1A1 (0.38) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL17082101 0.91 ALDH1A1 (0.38) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL17082172 0.89 PDE7A (0.39) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL4572363 0.89 PDE7A (0.39) ALDH1A1NPC1RAB9AKDM4EMAPT

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