SCHEMBL28058280

SCHEMBL28058280

NS(=O)(=O)Nc1ccc(CC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
ALDH1A1 P00352 1/20 0.55
POLB P06746 1/20 0.55
CA2 P00918 11/20 0.55
CA1 P00915 10/20 0.55
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CAMK2A Q9UQM7 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL1422207 0.81 ALDH1A1 (0.63) GAAALDH1A1POLBL3MBTL1
SCHEMBL1421898 0.80 HPGD (0.65) GAAALDH1A1POLBL3MBTL1
SCHEMBL15956967 0.79 CA1 (0.53) CA2CA1CA12CA9
SCHEMBL5205017 0.77 HDAC1 (0.75) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL19177180 0.77 MAPK1 (0.57) GAAALDH1A1POLBCA2CA1
SCHEMBL27884380 0.77 KMT2A (0.61) GAAALDH1A1POLBCA2CA1
SCHEMBL8120226 0.76 CA1 (0.57) CA2CA1CA12CA9
SCHEMBL559891 0.76 CA2 (0.56) GAAALDH1A1POLBCA2MEN1
SCHEMBL5452372 0.76 GAA (0.51) GAAALDH1A1POLBMEN1KMT2A
SCHEMBL1422100 0.76 HPGD (0.66) GAAALDH1A1POLBCA2CA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110143999-A Have cytotoxicity and antimitotic compound and its application method 酵活有限公司 2019-08-20 CN disclosed
CN-105358174-B Cytotoxic and antimitotic compounds and methods of use thereof 酵活有限公司 2019-03-15 CN disclosed
CN-106459162-A VAR2CSA-drug conjugates 酵活有限公司 2017-02-22 CN disclosed
CN-105358174-A Cytotoxic and antimitotic compounds and methods of use thereof CT FOR DRUG RES AND DEV 2016-02-24 CN disclosed