SCHEMBL10778388

SCHEMBL10778388

[N-]=[N+]=CC(=O)C1=CC(=O)C=CC1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
HIF1A Q16665 1/20 0.37
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NR4A1 P22736 1/20 0.30

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
SCHEMBL6252379 0.75 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL28327160 0.69 TDP1 (0.42) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL11305926 0.68 ERBB2 (0.31) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL865959 0.68 ALDH1A1 (0.42) ALDH1A1MEN1KMT2AHIF1AMAPT
SCHEMBL134429 0.68 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL1287162 0.66 ERBB2 (0.39) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL28198484 0.66 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AHIF1AMAPT
SCHEMBL2257187 0.66 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL26444866 0.64 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AHIF1AMAPT
Water SCHEMBL28540739 0.64 ERBB2 (0.38) ALDH1A1MEN1KMT2AMAPTHPGD

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-4657556-A NONIONIC SURFACTANTS; FOAMING AGENTS; DISPERSANTS L'OREAL (FR) 1987-04-14 US disclosed