SCHEMBL11670933

SCHEMBL11670933

CC(=O)OCCN(CC(=O)c1ccccc1)c1cccc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.36
PTGIR P43119 1/20 0.36
PTGDR Q13258 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
MDM2 Q00987 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36

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
SCHEMBL11672252 0.87 RAD52 (0.42) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL11671772 0.87 PPARG (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1PTGIR
SCHEMBL11408687 0.86 MAPT (0.54) MAPTKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL11671140 0.85 MTNR1A (0.49) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL11670553 0.84 MAPT (0.45) MAPTMEN1KMT2AKDM4EERCC5
SCHEMBL11670488 0.82 MAPT (0.46) MAPTMEN1KMT2AKDM4EERCC5
SCHEMBL11715218 0.82 MAPT (0.46) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL11671104 0.81 ALDH1A1 (0.52) MAPTMEN1KMT2AKDM4EERCC5
SCHEMBL11742719 0.81 MAPT (0.49) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL11670136 0.81 MEN1 (0.45) MAPTMEN1KMT2AKDM4EERCC5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 US disclosed