SCHEMBL9633891

SCHEMBL9633891

NC(=O)c1ccc(OC=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 18/20 0.61
PARP15 Q460N3 5/20 0.61
PARP4 Q9UKK3 2/20 0.61
PARP14 Q460N5 2/20 0.61
ALDH1A1 P00352 1/20 0.61
KMT2A Q03164 1/20 0.61
PARP16 Q8N5Y8 1/20 0.61
PARP11 Q9NR21 1/20 0.61
PARP3 Q9Y6F1 1/20 0.58
PARP2 Q9UGN5 4/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
PARP1 P09874 1/20 0.57
AOC3 Q16853 1/20 0.49
TNKS O95271 1/20 0.47
TNKS2 Q9H2K2 1/20 0.47

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
SCHEMBL1344670 0.83 PARP10 (0.63) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL10077968 0.81 HTT (0.41) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL28554610 0.81 PARP10 (0.59) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL6054668 0.80 CA1 (0.56) PARP10PARP15ALDH1A1KMT2ACA1
SCHEMBL25512146 0.79 CA1 (0.39) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL4630373 0.79 PARP10 (0.62) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL11306924 0.78 MAPT (0.61) ALDH1A1KMT2A
SCHEMBL6454577 0.78 ALDH1A1 (0.38) ALDH1A1CA1CA2
SCHEMBL14405879 0.77 HSD17B10 (0.53) PARP10ALDH1A1KMT2A
SCHEMBL14390120 0.77 HSD17B10 (0.53) PARP10ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276124-B1 PROSTAGLANDIN DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE Sankyo Company Limited (JP) 1992-05-20 EP disclosed
US-4981872-A ANTIULCER SANKYO COMPANY LIMITED (JP) 1991-01-01 US disclosed
US-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 EP disclosed
EP-0276124-A2 Prostaglandin derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1988-07-27 EP disclosed