SCHEMBL14068428

SCHEMBL14068428

COCCNC(=O)CN(C)Cc1ccc(C(=O)N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.59
KMT2A Q03164 7/20 0.59
RAB9A P51151 1/20 0.59
HDAC1 Q13547 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
CTSS P25774 3/20 0.49
CTSL P07711 2/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
CTSK P43235 1/20 0.48
LMNA P02545 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47

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
SCHEMBL14025827 0.84 KDM4E (0.59) MEN1KMT2ARAB9AHDAC1HDAC6
SCHEMBL4922041 0.81 KMT2A (0.52) MEN1KMT2AHDAC1HDAC6HDAC3
SCHEMBL17117491 0.78 MEN1 (0.84) MEN1KMT2ARAB9AHDAC1HDAC6
SCHEMBL4741844 0.78 KMT2A (0.65) MEN1KMT2ARAB9AHDAC1HDAC6
SCHEMBL39945 0.78 KDM4E (0.56) KDM4ELMNASIGMAR1TMEM97ACHE
SCHEMBL3655080 0.77 MEN1 (0.73) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL4914918 0.76 POLB (0.54) MEN1KMT2ARAB9AHDAC1HDAC6
SCHEMBL14025829 0.76 HDAC1 (0.46) MEN1KMT2AHDAC1HDAC6HDAC3
SCHEMBL17117334 0.76 KMT2A (0.85) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL4926596 0.74 ACHE (0.46) MEN1KMT2ARAB9AHDAC1HDAC6

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
WO-2008109154-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS, INC. (US) 2008-09-12 WO disclosed