SCHEMBL789192

SCHEMBL789192

CS(=O)(=O)c1ccc(O[C@@H]2CNCCC2N2CCCC2=O)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.40
SLC9A3 P48764 3/20 0.35
PTGS2 P35354 1/20 0.35
BRD4 O60885 7/20 0.35
CYP2C9 P11712 1/20 0.35
SLC6A9 P48067 4/20 0.34
HTR2C P28335 1/20 0.34

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
Hydrochloric Acid SCHEMBL2597110 0.99 GPR119 (0.40) GPR119SLC9A3PTGS2BRD4CYP2C9
Hydrochloric Acid SCHEMBL14917661 0.90 BRD4 (0.35) GPR119BRD4HTR2C
Hydrochloric Acid SCHEMBL789439 0.86 SLC9A3 (0.32) SLC9A3
SCHEMBL788886 0.85 SCN9A (0.34) HTR2C
SCHEMBL790469 0.85 SCN9A (0.34) HTR2C
SCHEMBL789216 0.80 SLC6A9 (0.34) GPR119BRD4SLC6A9
Hydrochloric Acid SCHEMBL2597053 0.77 TSHR (0.31)
SCHEMBL2597109 0.76 SLC6A9 (0.37) GPR119BRD4SLC6A9
SCHEMBL789299 0.76 DPP4 (0.30)
SCHEMBL14795126 0.76 GPR119 (0.38) GPR119SLC9A3PTGS2BRD4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616074-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-07-24 EP disclosed
WO-2013066869-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2013-05-10 WO disclosed
WO-2012037393-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2012-03-22 WO disclosed