SCHEMBL6974847

SCHEMBL6974847

O=C(O)CN1C(=O)C(=O)N(CN2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.71
CA9 Q16790 1/20 0.71
ALDH1A1 P00352 4/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 3/20 0.53
MEN1 O00255 2/20 0.53
KDM4E B2RXH2 2/20 0.53
CYP1A2 P05177 1/20 0.53
AKR1B1 P15121 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TDP1 Q9NUW8 1/20 0.46
GSK3B P49841 1/20 0.46
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL29744481 0.84 CA12 (1.00) CA12CA9ALDH1A1KMT2AMAPT
SCHEMBL522649 0.84 CA12 (1.00) CA12CA9ALDH1A1KMT2AMAPT
Hydrochloric Acid SCHEMBL7085111 0.82 CA12 (0.96) CA12CA9ALDH1A1KMT2AMAPT
Phosphine SCHEMBL31113454 0.82 CA12 (0.96) CA12CA9ALDH1A1KMT2AMAPT
SCHEMBL7133295 0.79 KMT2A (0.60) CA12CA9ALDH1A1KMT2AMAPT
SCHEMBL2604740 0.78 CA12 (0.58) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL8143584 0.76 KMT2A (0.76) CA12CA9ALDH1A1KMT2AMAPT
Phthalic Acid SCHEMBL30666341 0.76 CA12 (0.82) CA12CA9ALDH1A1KMT2AMAPT
SCHEMBL8151455 0.73 MAPT (0.56) CA12CA9ALDH1A1KMT2AMAPT
SCHEMBL8136034 0.72 CA12 (0.55) CA12CA9ALDH1A1KMT2AMAPT

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
EP-0718289-B1 Novel parabanic acid derivatives as aldose reductase inhibitors NIPPON ZOKI PHARMACEUTICAL CO (JP) 2003-03-05 EP disclosed
US-5681843-A ANTIDIABETIC; ALDOSE REDUCTASE INHIBITOR WITHOUT SUBSTANTIALLY INHIBITING ALDEHYDE REDUCATASE NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1997-10-28 US disclosed
EP-0718289-A1 Novel parabanic acid derivatives as aldose reductase inhibitors NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1996-06-26 EP disclosed