SCHEMBL9724955

SCHEMBL9724955

O=C(O)c1cccc2c1NCCC2C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.43
LIG1 P18858 1/20 0.37
NR4A1 P22736 1/20 0.36
ALDH1A1 P00352 4/20 0.36
F12 P00748 9/20 0.35
ALOX15 P16050 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
GFER P55789 1/20 0.35
KMT2A Q03164 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL19644218 0.81 F12 (0.50) F12MAPT
SCHEMBL22492714 0.81 F12 (0.45) ALDH1A1F12
SCHEMBL19644353 0.81 F12 (0.50) F12
SCHEMBL22492362 0.79 F12 (0.47) F12KDM4EMEN1MAPTKMT2A
SCHEMBL22492639 0.78 F2 (0.48) ALDH1A1F12KDM4EMEN1GAA
SCHEMBL22492441 0.78 F12 (0.48) ALDH1A1F12MEN1GAAKMT2A
SCHEMBL9724928 0.76 KDM4E (0.38) KDM4EMEN1MAPTKMT2A
SCHEMBL9725039 0.74 PTGDR2 (0.32)
SCHEMBL768982 0.73 ALDH1A1 (0.54) ALDH1A1F12
SCHEMBL30899479 0.73 ALDH1A1 (0.54) ALDH1A1F12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5112836-A Autoimmune diseases, antirheumatic agents and metabolic bone diseases KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-05-12 US disclosed
CN-1048216-A Novel ring o-amino benzoyl acid carboxylic acid derivatives SHU OGIHARA CO LTD (JP) 1991-01-02 CN disclosed
EP-0403980-A1 Novel cyclic anthranilic acid carboxylic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-12-27 EP disclosed