SCHEMBL11264759

SCHEMBL11264759

CC(C)(Oc1cccc(C(F)(F)F)c1)C(=O)CP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ACP3 P15309 3/20 0.47
ATM Q13315 1/20 0.43
MAPT P10636 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
MMP2 P08253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAOB P27338 1/20 0.41
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.39
NPY5R Q15761 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL6722309 0.81 CNR1 (0.43) KDM4EMAPTPPARGPPARAPOLB
SCHEMBL1618680 0.80 PPARG (0.44) KDM4EMAPTPPARGPPARAALDH1A1
SCHEMBL3372794 0.79 PPARG (0.51) KDM4EATMMAPTPPARGPPARA
SCHEMBL10566944 0.79 KDM4E (0.48) KDM4EATMMAPTPPARGPPARA
SCHEMBL11570463 0.77 KDM4E (0.50) KDM4EATMMAPTPPARGPPARA
SCHEMBL4779899 0.77 KDM4E (0.50) KDM4EATMMAPTPPARGPPARA
SCHEMBL5575155 0.76 KDM4E (0.63) KDM4EACP3MAPTMRGPRX4MAOB
SCHEMBL14269947 0.75 NPSR1 (0.49) KDM4EMAPTPPARGPPARAMRGPRX4
SCHEMBL9466283 0.75 PPARA (0.41) KDM4EMAPTPPARGPPARAALDH1A1
SCHEMBL10344024 0.73 PPARG (0.52) KDM4EACP3MAPTPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4346228-A Novel 11-oxoprostaglandin derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1982-08-24 US disclosed