SCHEMBL22443604

SCHEMBL22443604

CSc1ccc(C(O)C2CCC(C)(C)N2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.33
FPR2 P25090 3/20 0.31
DPP4 P27487 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
EPHX2 P34913 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL22443440 1.00 SLC6A4 (0.33) SLC6A4FPR2DPP4DPP8DPP9
SCHEMBL22443444 1.00 SLC6A4 (0.33) SLC6A4FPR2DPP4DPP8DPP9
SCHEMBL22443443 1.00 SLC6A4 (0.33) SLC6A4FPR2DPP4DPP8DPP9
SCHEMBL22443612 0.83 SLC6A3 (0.39)
SCHEMBL22443659 0.82 HTR2A (0.40)
SCHEMBL22443660 0.82 HTR2A (0.40)
SCHEMBL22443565 0.82 HTR2A (0.40)
SCHEMBL22443561 0.82 HTR2A (0.40)
SCHEMBL22443567 0.82 HTR2A (0.40)
SCHEMBL11116777 0.82 SLC6A2 (0.38) SLC6A4FPR2

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-3941468-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA Atrogi AB (SE) 2022-01-26 EP disclosed
WO-2020188301-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2020-09-24 WO disclosed