SCHEMBL17081986

SCHEMBL17081986

CCNC(=O)c1ccc(N2CCC[C@@]3(CCN(c4ccccc4Cl)C3=O)C2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.43
ALDH1A1 P00352 7/20 0.43
RAB9A P51151 6/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 2/20 0.43
HPGD P15428 6/20 0.41
MAPK8 P45983 6/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
NPC1 O15118 5/20 0.40
MAPT P10636 2/20 0.40
HDAC1 Q13547 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD11B1 P28845 1/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38

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
SCHEMBL549509 1.00 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1RAB9AKDM4EMAPK1
SCHEMBL549913 0.91 CRBN (0.42) SMN1; SMN2ALDH1A1RAB9AKDM4EMAPK1
SCHEMBL17081985 0.91 CRBN (0.42) SMN1; SMN2ALDH1A1RAB9AKDM4EMAPK1
SCHEMBL17082015 0.81 CRBN (0.42) ALDH1A1RAB9AKDM4ECRBNNPSR1
SCHEMBL4570055 0.81 CRBN (0.42) ALDH1A1RAB9AKDM4ECRBNNPSR1
SCHEMBL549536 0.81 HSD11B1 (0.41) ALDH1A1CRBNMAPTHSD11B1TSHR
SCHEMBL2704081 0.81 HSD11B1 (0.41) ALDH1A1CRBNMAPTHSD11B1TSHR
SCHEMBL2701119 0.81 CRBN (0.44) SMN1; SMN2RAB9ACRBNMAPTHTT
SCHEMBL3700460 0.81 CRBN (0.44) SMN1; SMN2RAB9ACRBNMAPTHTT
SCHEMBL5930600 0.81 CRBN (0.44) SMN1; SMN2RAB9ACRBNMAPTHTT

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