SCHEMBL7304754

SCHEMBL7304754

NC(=O)c1[c]cc(C(N)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 9/20 0.41
PARP4 Q9UKK3 2/20 0.41
PARP15 Q460N3 2/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
PARP14 Q460N5 1/20 0.41
PARP16 Q8N5Y8 1/20 0.41
PARP11 Q9NR21 1/20 0.41
PARP1 P09874 3/20 0.41
TSHR P16473 2/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5830407 0.81 ALDH1A1 (0.43) PARP10PARP4ALDH1A1KMT2APARP1
SCHEMBL1303104 0.79 PARP10 (0.43) PARP10PARP4PARP15ALDH1A1KMT2A
SCHEMBL5830651 0.77 PLA2G7 (0.41) ALDH1A1TDP1CA2CA1SMN1; SMN2
SCHEMBL5830173 0.77 HPGD (0.55) ALDH1A1KMT2ATSHRMAPTL3MBTL1
SCHEMBL5830139 0.77 HPGD (0.50) ALDH1A1KMT2APOLBHSD17B10CA2
SCHEMBL15654666 0.76 KCNN4 (0.38) PARP10ALDH1A1PARP1CYP3A4CYP2C19
SCHEMBL96927 0.76 PARP1 (0.41) PARP10PARP4PARP15ALDH1A1KMT2A
SCHEMBL9901869 0.76 PARP1 (0.41) PARP10PARP4PARP15ALDH1A1KMT2A
SCHEMBL3609237 0.76 NPC1 (0.38) ALDH1A1KMT2APARP1TSHRMAPT
SCHEMBL10636083 0.76 PARP1 (0.36) PARP10ALDH1A1KMT2APARP1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507243-A1 SPIROINDOLINONE PYRROLIDINES F. Hoffmann-La Roche AG (CH) 2012-10-10 EP disclosed
US-5792840-A SUBSTITUTED GLUCOPYRANOSYL PHOSPHATES SANKYO COMPANY, LIMITED (JP) 1998-08-11 US disclosed
US-5629406-A AMINO ACID DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1997-05-13 US disclosed
EP-0437016-B1 Lipid A analogues having immunoactivating and anti-tumour activity SANKYO CO (JP) 1996-05-01 EP disclosed
EP-0587311-A1 Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed
EP-0583971-A1 Piperidine derivatives SANKYO COMPANY LIMITED (JP) 1994-02-23 EP disclosed
EP-0498680-A1 New beta-amino-alpha-hydroxycarboxylic acids and their use Sankyo Company Limited (JP) 1992-08-12 EP disclosed