SCHEMBL6156971

SCHEMBL6156971

NC(=O)c1ccccc1CNC(=O)C[O]

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 6/20 0.43
HPGD P15428 6/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HTT P42858 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
RCE1 Q9Y256 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
METAP2 P50579 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL28984805 0.81 SETDB1 (0.49) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL19091144 0.80 HPGD (0.45) MAPK8HPGDALDH1A1KDM4EMAPT
Hydrochloric Acid SCHEMBL20487425 0.79 HPGD (0.42) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL4422142 0.78 NPC1 (0.46) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL6264342 0.78 HPGD (0.49) HPGDALDH1A1KDM4EMAPTTSHR
SCHEMBL6158947 0.77 KCNA5 (0.42) HPGDALDH1A1KDM4EHTTLMNA
SCHEMBL1671880 0.77 KDM4E (0.48) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL4019795 0.77 HPGD (0.45) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL13516667 0.76 GAA (0.40) MAPK8HPGDALDH1A1KDM4EMAPT
SCHEMBL14941044 0.76 ALDH1A1 (0.43) HPGDALDH1A1KDM4ETSHRHTT

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
EP-1597245-A1 BENZOTHIAZEPINE AND BENZOTHIEPINE DERIVATIVES AstraZeneca AB (SE) 2005-11-23 EP disclosed
EP-1501813-A2 BENZOTHIADIAZEPINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Astrazeneca AB (SE) 2005-02-02 EP disclosed
WO-2004076430-A1 BENZOTHIAZEPINE AND BENZOTHIEPINE DERIVATIVES ASTRAZENECA AB (SE) 2004-09-10 WO disclosed
WO-2003091232-A2 BENZOTHIADIAZEPINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2003-11-06 WO disclosed