SCHEMBL10993438

SCHEMBL10993438

O=C(C1CC1)N1CC(=O)N(CCc2ccccc2)C(O)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.45
ALDH1A1 P00352 6/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HPGD P15428 2/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 2/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 2/20 0.40
HTR2A P28223 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL10966952 0.94 KDM4E (0.47) HTTALDH1A1BLMKMT2AKDM4E
SCHEMBL9835390 0.87 KDM4E (0.54) HTTALDH1A1BLMKMT2AKDM4E
SCHEMBL10994286 0.80 ALDH1A1 (0.55) HTTALDH1A1BLMKMT2AL3MBTL1
SCHEMBL10994902 0.79 ALDH1A1 (0.49) ALDH1A1KMT2AKDM4EHPGDRAB9A
SCHEMBL17736334 0.76 MCHR1 (0.47) HTTALDH1A1KMT2AL3MBTL1USP2
SCHEMBL10966470 0.74 ALDH1A1 (0.52) HTTALDH1A1BLMKMT2AKDM4E
SCHEMBL25989656 0.74 ALDH1A1 (0.52) HTTALDH1A1KMT2AL3MBTL1USP2
SCHEMBL11034497 0.72 TSHR (0.43) ALDH1A1KMT2AKDM4EUSP2TSHR
SCHEMBL19721600 0.72 MCHR1 (0.51) HTTALDH1A1BLMKMT2AKDM4E
SCHEMBL13150784 0.72 MEN1 (0.64) ALDH1A1BLMKMT2AUSP2TSHR

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
US-4523013-A 4-Acyl-2,6-dioxo-1-phenethyl piperozines SANOFI, S.A. (FR) 1985-06-11 US disclosed