SCHEMBL11575816

SCHEMBL11575816

CC(=O)CC(=O)Nc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
ALDH1A1 P00352 5/20 0.49
POLB P06746 2/20 0.47
TDP1 Q9NUW8 1/20 0.45
MAPT P10636 4/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42
KDM4E B2RXH2 2/20 0.41
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
CDC7 O00311 1/20 0.39
PLK4 O00444 1/20 0.39
DYRK3 O43781 1/20 0.39
JAK2 O60674 1/20 0.39
ROCK2 O75116 1/20 0.39

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
SCHEMBL2912176 0.93 MEN1 (0.54) MEN1KMT2AALDH1A1POLBTDP1
SCHEMBL12720508 0.84 MEN1 (0.80) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL11576411 0.84 CYP3A4 (0.54) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL10427609 0.80 MEN1 (0.53) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL9180503 0.77 HPGD (0.68) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL31590796 0.77 HPGD (0.68) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL54924 0.77 MEN1 (0.80) MEN1KMT2AALDH1A1POLBTDP1
SCHEMBL11222525 0.77 MEN1 (0.51) MEN1KMT2AALDH1A1POLBTDP1
SCHEMBL2914539 0.77 ALDH1A1 (0.54) MEN1KMT2AALDH1A1POLBTDP1
SCHEMBL7133200 0.77 ALDH1A1 (0.55) MEN1KMT2AALDH1A1POLBTDP1

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-4169091-A Symmetrical and asymmetrical disazo compounds containing a bis-(nitro-aryloxy)alkane middle component HOECHST AKTIENGESELLSCHAFT (DE) 1979-09-25 US disclosed