SCHEMBL7667262

SCHEMBL7667262

NC(C(=O)/C=C/c1ccc(/C=C/c2ccncc2)nc1)c1cccn1-c1ccc(Cl)c(CO)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 8/20 0.36
NOTUM Q6P988 1/20 0.33
AKT1 P31749 3/20 0.31
CDC7 O00311 1/20 0.31
DAPK3 O43293 1/20 0.31
DYRK3 O43781 1/20 0.31
ROCK2 O75116 1/20 0.31
RPS6KA5 O75582 1/20 0.31
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
PIM1 P11309 1/20 0.31
PHKG2 P15735 1/20 0.31
PRKACA P17612 1/20 0.31
RPS6KB1 P23443 1/20 0.31
MARK3 P27448 1/20 0.31
AKT2 P31751 1/20 0.31
PRKCI P41743 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
CLK2 P49760 1/20 0.31

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
SCHEMBL7654571 0.85 BDKRB2 (0.37) BDKRB2
SCHEMBL7013017 0.84 BDKRB2 (0.37) BDKRB2ROCK2ROCK1
SCHEMBL7007280 0.83 BDKRB2 (0.59) BDKRB2
SCHEMBL7667827 0.82 BDKRB2 (0.49) BDKRB2
SCHEMBL7012997 0.81 BDKRB2 (0.35) BDKRB2
SCHEMBL7667265 0.80 BDKRB2 (0.54) BDKRB2
SCHEMBL7667268 0.80 BDKRB2 (0.54) BDKRB2
SCHEMBL7012781 0.80 BDKRB2 (0.46) BDKRB2
SCHEMBL7016580 0.80 BDKRB2 (0.40) BDKRB2NOTUM
SCHEMBL7012066 0.79 BDKRB2 (0.47) BDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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