SCHEMBL20049072

SCHEMBL20049072

CCC(C)C(F)(F)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP4 P27487 1/20 0.31
KIF11 P52732 1/20 0.31
FFAR3 O14843 1/20 0.30
TSHR P16473 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
SCHEMBL8413987 0.81 CHRM1 (0.41) TSHR
SCHEMBL8414423 0.78 RNPEP (0.39)
SCHEMBL11723613 0.76 GRM2 (0.34) DPP8DPP7DPP4KIF11
SCHEMBL21984836 0.76 THRB (0.30)
SCHEMBL7761207 0.76
SCHEMBL7347545 0.75 TSHR (0.42) FFAR3TSHR
SCHEMBL1706440 0.75 MAPT (0.31) FFAR3
SCHEMBL7347552 0.75 TSHR (0.42) FFAR3TSHR
SCHEMBL8200989 0.75 CTRB1 (0.38)
SCHEMBL765722 0.75 EPHX1 (0.34)

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
WO-2018067704-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2018-04-12 WO disclosed