SCHEMBL7014193

SCHEMBL7014193

CCOC(=O)c1cccn1-c1ccc(Cl)c(COS(C)(=O)=O)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 5/20 0.36
GABRB2 P47870 5/20 0.36
ALDH1A1 P00352 6/20 0.36
MAPT P10636 6/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NOD2 Q9HC29 1/20 0.35
NOD1 Q9Y239 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 3/20 0.33
GAA P10253 1/20 0.33
PDE4B Q07343 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL7010644 0.85 NOTUM (0.40) GABRA2GABRB2ALDH1A1MAPTKDM4E
SCHEMBL7013353 0.78 GABRB2 (0.38) GABRA2GABRB2ALDH1A1MAPTSMN1; SMN2
SCHEMBL7012421 0.77 GAA (0.41) ALDH1A1L3MBTL1GAA
SCHEMBL7007149 0.77 CYP1A2 (0.43) ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL7012618 0.77 BDKRB2 (0.42) ALDH1A1MAPTSMN1; SMN2
SCHEMBL7008980 0.76 BDKRB2 (0.40) ALDH1A1MAPTSMN1; SMN2L3MBTL1LMNA
SCHEMBL7012620 0.73 CYP1A2 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL7008977 0.72 GAA (0.34) ALDH1A1SMN1; SMN2MAPK1LMNAGAA
SCHEMBL18299679 0.67 LMNA (0.43) ALDH1A1SMN1; SMN2LMNATP53
SCHEMBL6022038 0.66 TSHR (0.44) GABRB2ALDH1A1MAPTSMN1; SMN2NOD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861243-B1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2003-11-12 EP disclosed
US-6344462-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-05 US disclosed
US-6100284-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-08 US disclosed
US-6008229-A TREATING ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0861243-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-02 EP disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed