SCHEMBL25366158

SCHEMBL25366158

CCOC(=O)Cc1ncc(F)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 1/20 0.50
DPP4 P27487 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
MAPT P10636 4/20 0.40
MAOB P27338 2/20 0.40
MAPK1 P28482 1/20 0.40
CASP3 P42574 1/20 0.38
CASP7 P55210 1/20 0.38
CASP9 P55211 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL10515631 0.85 DPP4 (0.43) DPP4SMN1; SMN2MAPTMAPK1CASP3
SCHEMBL10132043 0.84 AGBL2 (0.50) AGBL2DPP4SMN1; SMN2MAPTMAOB
SCHEMBL10515506 0.83 DPP4 (0.41) DPP4SMN1; SMN2MAPTMAOBMAPK1
SCHEMBL26091014 0.83 CYP2C19 (0.42) DPP4SMN1; SMN2MAPTMAPK1CASP3
SCHEMBL17548192 0.81 SMN1; SMN2 (0.48) AGBL2DPP4SMN1; SMN2MAPTMAOB
SCHEMBL31042960 0.81 AGBL2 (0.48) AGBL2DPP4SMN1; SMN2MAPTMAOB
SCHEMBL10515102 0.81 MEN1 (0.40) DPP4SMN1; SMN2MAPTMAPK1CASP3
SCHEMBL23566852 0.80 AGBL2 (0.51) AGBL2AGTR1AGTR2MEN1KMT2A
SCHEMBL10515471 0.80 SMN1; SMN2 (0.49) SMN1; SMN2MAPTMAPK1CASP3CASP7
SCHEMBL17548191 0.80 AGBL2 (0.43) AGBL2DPP4SMN1; SMN2MAPTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4674841-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2026-01-07 EP disclosed
CN-118973578-A Pharmaceutical compounds 杜克街生物有限公司 2024-11-15 CN disclosed
EP-4444305-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2024-10-16 EP disclosed
WO-2023156386-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2023-08-24 WO disclosed
WO-2023156386-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2023-08-24 WO disclosed