SCHEMBL21043487

SCHEMBL21043487

CCC(F)(CC)CN1CCC(COc2ccc(Cc3ccc(C(=O)O)cc3)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.52
SSTR5 P35346 2/20 0.52
HTR4 Q13639 1/20 0.43
LTA4H P09960 2/20 0.42
PARP15 Q460N3 1/20 0.42
PARP10 Q53GL7 1/20 0.42
PARP2 Q9UGN5 1/20 0.42
SLC6A5 Q9Y345 1/20 0.41
SIGMAR1 Q99720 2/20 0.41

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
SCHEMBL15539858 0.92 SSTR5 (0.55) KCNH2SSTR5PARP15PARP10PARP2
SCHEMBL15539042 0.84 SSTR5 (0.48) KCNH2SSTR5HTR4
SCHEMBL15538422 0.83 GPR119 (0.51) KCNH2SSTR5
SCHEMBL16758044 0.82 SSTR5 (0.51) KCNH2SSTR5PARP15PARP10
SCHEMBL15540075 0.82 SSTR5 (0.51) KCNH2SSTR5
SCHEMBL15539517 0.81 DRD2 (0.46) KCNH2SSTR5
SCHEMBL15537615 0.81 SSTR5 (0.55) KCNH2SSTR5PARP15PARP10PARP2
SCHEMBL15539114 0.80 SSTR5 (0.47) KCNH2SSTR5SIGMAR1
SCHEMBL15539161 0.80 RARA (0.54) KCNH2SSTR5PARP15PARP10
SCHEMBL18818377 0.79 ACHE (0.44) KCNH2SSTR5HTR4

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
EP-3074384-B1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2019-05-22 EP disclosed