SCHEMBL7012296

SCHEMBL7012296

CC(C)(C)[Si](OCc1c(Cl)ccc(-n2cccc2C(=O)O)c1Cl)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC16A3 O15427 9/20 0.32
SLC16A1 P53985 8/20 0.32
BDKRB2 P30411 2/20 0.32
MCTS1 Q9ULC4 1/20 0.30

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
SCHEMBL7013353 0.89 GABRB2 (0.38) POLBTDP1L3MBTL1SLC16A3SLC16A1
SCHEMBL7014975 0.86 NOTUM (0.31)
SCHEMBL7011250 0.84 GAA (0.39) L3MBTL1BDKRB2
SCHEMBL7005740 0.83 BDKRB2 (0.41) POLBSLC16A3SLC16A1BDKRB2
SCHEMBL7006530 0.82 BDKRB2 (0.32) BDKRB2
SCHEMBL7007702 0.82 LMNA (0.32)
SCHEMBL7012849 0.81 BDKRB2 (0.40) POLBBDKRB2
SCHEMBL8722561 0.81 BDKRB2 (0.36) POLBBDKRB2
SCHEMBL7008463 0.80 CYP1A2 (0.32)
SCHEMBL7005681 0.80 BDKRB2 (0.40) POLBL3MBTL1BDKRB2

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