SCHEMBL11575484

SCHEMBL11575484

COc1cc(NC(C)=O)c(Cl)cc1NC(=O)CC(C)=O

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
SMN1; SMN2 Q16637 1/20 0.56
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.48
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.46

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
SCHEMBL2914320 0.96 ALDH1A1 (0.67) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL11576993 0.88 ALDH1A1 (0.68) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL11775480 0.88 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL7130005 0.87 ALDH1A1 (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL31570092 0.87 ALDH1A1 (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL1118436 0.87 SMN1; SMN2 (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL29466463 0.87 SMN1; SMN2 (0.73) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL2914361 0.86 ALDH1A1 (0.69) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL2914539 0.83 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AGAAHPGD
SCHEMBL10891532 0.81 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA

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