SCHEMBL28320394

SCHEMBL28320394

NNOC(=O)c1ccc(C(=O)ON2C(=O)CCC2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
MGLL Q99685 2/20 0.36
KMT2A Q03164 5/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA9 Q16790 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
GAA P10253 1/20 0.31

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
Hydrochloric Acid SCHEMBL28721885 0.98 ALDH1A1 (0.37) ALDH1A1HPGDMGLLKMT2AMEN1
SCHEMBL300884 0.86 CA12 (0.42) ALDH1A1HPGDMGLLKMT2AMEN1
SCHEMBL16938405 0.84 MAPT (0.54) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL20133945 0.84 ALDH1A1 (0.43) ALDH1A1HPGDMGLLKMT2AMEN1
Hydrochloric Acid SCHEMBL7910504 0.83 ALDH1A1 (0.43) ALDH1A1HPGDMGLLKMT2AMEN1
Hydrochloric Acid SCHEMBL29064019 0.83 MAPT (0.53) ALDH1A1HPGDMGLLKMT2AMEN1
Hydrochloric Acid SCHEMBL7910402 0.83 ALDH1A1 (0.43) ALDH1A1HPGDMGLLKMT2AMEN1
SCHEMBL12216547 0.81 LMNA (0.44) ALDH1A1HPGDKMT2AMAPTCA12
SCHEMBL14640220 0.81 ALDH1A1 (0.54) ALDH1A1HPGDMGLLKMT2AMEN1
SCHEMBL27807368 0.81 PARP10 (0.42) ALDH1A1HPGDKMT2AMAPTPOLB

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
CN-110267685-A Target the immunoconjugates and its application method of ADAM9 伊缪诺金公司 2019-09-20 CN disclosed