SCHEMBL8568386

SCHEMBL8568386

CC(C)Oc1ccc(Cl)c(COS(C)(=O)=O)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.38
RORC P51449 1/20 0.35
LDHA P00338 2/20 0.33
LDHB P07195 1/20 0.33
POLB P06746 1/20 0.33
ACLY P53396 1/20 0.32
KMO O15229 1/20 0.32
EZH2 Q15910 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PTGDR Q13258 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL8567935 0.83 ALDH1A1 (0.40) RORCPOLBLMNAKMT2ACYP1A2
SCHEMBL6643661 0.78 CLCN2 (0.41)
SCHEMBL8563626 0.74 CSNK2A1 (0.44) CSNK2A1RORCLDHALDHBKMO
SCHEMBL31373399 0.72 RECQL (0.42) POLBLMNAKMT2AALDH1A1
SCHEMBL18299679 0.72 LMNA (0.43) MEN1LMNAKMT2ACYP1A2ALDH1A1
SCHEMBL6961763 0.71 TDP1 (0.49) POLBMAPTALDH1A1
SCHEMBL21386635 0.68 TRPV4 (0.35) POLBMAPTALDH1A1
SCHEMBL7656482 0.68 NPC1 (0.31)
SCHEMBL18299439 0.67 CA12 (0.36) POLBLMNACYP1A2MAPTALDH1A1
SCHEMBL15414825 0.67 CYP2A6 (0.42) MEN1LMNAKMT2ACYP1A2MAPT

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-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed