SCHEMBL1672012

SCHEMBL1672012

CC(C)(C)C1CC(S(=O)(=O)N2CCC(c3cc(F)c(OC4CN(Cc5ccc(C(F)(F)F)cc5)C4)c(F)c3)CC2)CCN1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KCNH2 Q12809 4/20 0.37
GPR119 Q8TDV5 3/20 0.37
PIK3CA P42336 2/20 0.35
PRKAA2 P54646 2/20 0.35
CNR1 P21554 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
CYP3A4 P08684 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33
PRKAG2 Q9UGJ0 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
SCHEMBL11903802 0.88 CHRM2 (0.40) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1670842 0.87 KDM4E (0.39) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1672013 0.83 P2RY14 (0.41) KCNH2GPR119PIK3CAPRKAA2CNR1
SCHEMBL1668353 0.82 P2RY14 (0.39) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1668410 0.81 KDM4E (0.49) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1668229 0.81 CNR1 (0.37) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1668510 0.81 HIF1A (0.38) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1668675 0.79 CNR1 (0.36) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1671394 0.79 EPHX2 (0.46) KDM4EALDH1A1KCNH2GPR119PIK3CA
SCHEMBL1668754 0.78 EPHX2 (0.40) KDM4EALDH1A1KCNH2GPR119PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486033-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2012-08-15 EP disclosed
WO-2011044001-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-04-14 WO disclosed