SCHEMBL11577296

SCHEMBL11577296

CC(=O)CC(=O)Nc1cccc(Cl)c1C

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
HPGD P15428 1/20 0.64
MAPK1 P28482 1/20 0.64
ALDH1A1 P00352 5/20 0.62
MAPT P10636 3/20 0.62
KDM4E B2RXH2 3/20 0.62
THRB P10828 1/20 0.58
POLB P06746 1/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL2986016 0.87 ALDH1A1 (0.67) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL4003436 0.85 LMNA (0.66) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL29678332 0.85 LMNA (0.66) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL14085811 0.85 ALDH1A1 (0.67) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL12720508 0.85 MEN1 (0.80) LMNAMAPK1ALDH1A1MAPTKDM4E
SCHEMBL300285 0.84 KMT2A (0.66) HPGDALDH1A1MAPTPOLBKMT2A
SCHEMBL29554472 0.84 KMT2A (0.66) HPGDALDH1A1MAPTPOLBKMT2A
SCHEMBL4210079 0.83 LMNA (0.64) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL31365405 0.83 HDAC3 (0.62) LMNAHPGDMAPK1ALDH1A1MAPT
SCHEMBL7078969 0.83 HDAC3 (0.62) LMNAHPGDMAPK1ALDH1A1MAPT

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