SCHEMBL12464402

SCHEMBL12464402

C=C1c2ccccc2C(=O)N1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
KMT2A Q03164 3/20 0.46
ELANE P08246 1/20 0.42
GAA P10253 1/20 0.41
CASP3 P42574 1/20 0.40
ALDH1A1 P00352 4/20 0.39
CYP1A2 P05177 1/20 0.39
EHMT2 Q96KQ7 1/20 0.39
EHMT1 Q9H9B1 1/20 0.39
MEN1 O00255 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
GLS O94925 1/20 0.38
CDC25B P30305 1/20 0.38
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
MC4R P32245 1/20 0.37

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
SCHEMBL13896437 0.98 POLB (0.54) POLBKMT2AELANEGAACASP3
SCHEMBL454827 0.84 POLB (0.67) POLBKMT2AELANEGAACASP3
SCHEMBL15887112 0.83 POLB (0.73) POLBKMT2AELANEGAACASP3
SCHEMBL28160078 0.82 POLB (0.64) POLBKMT2AELANEGAACASP3
SCHEMBL2022462 0.82 POLB (0.64) POLBKMT2AELANEGAACASP3
SCHEMBL12012884 0.74 RNASEH1 (0.47) POLBCASP3ALDH1A1CYP1A2EHMT2
SCHEMBL10262744 0.74 CASP3 (0.59) CASP3ALDH1A1GLS
SCHEMBL26491862 0.74 POLB (0.40) POLBKMT2AGAACASP3ALDH1A1
SCHEMBL9971188 0.74 POLB (0.40) POLBKMT2ACASP3ALDH1A1CYP1A2
SCHEMBL11229948 0.73 POLB (0.54) POLBKMT2AELANEGAACASP3

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
EP-2005500-B1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS UNIV SOUTHERN CALIFORNIA (US) 2011-07-06 EP disclosed