SCHEMBL26051147

SCHEMBL26051147

Cc1sc(N2CCOCC2)nc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.51
PIK3CD O00329 4/20 0.47
PIK3CA P42336 4/20 0.47
PIK3CB P42338 4/20 0.47
SMN1; SMN2 Q16637 6/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CNR2 P34972 1/20 0.41
PIK3CG P48736 3/20 0.40
ALOX15 P16050 1/20 0.40
PIK3C2B O00750 1/20 0.40
PIK3R1 P27986 1/20 0.40
MTOR P42345 1/20 0.40

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
SCHEMBL12086425 0.81 LMNA (0.47) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL26051145 0.80 PIK3CD (0.40) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL4850658 0.78 PIK3CD (0.61) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL31596098 0.77 ALDH1A1 (0.54) PIK3CDPIK3CAPIK3CBSMN1; SMN2KDM4E
SCHEMBL27843089 0.77 AR (0.42) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL2340680 0.76 PIK3CD (0.63) PIK3CDPIK3CAPIK3CBSMN1; SMN2KDM4E
SCHEMBL2334075 0.75 PIK3CA (0.51) PIK3CDPIK3CAPIK3CBSMN1; SMN2KDM4E
SCHEMBL16561758 0.75 AR (0.55) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL28003504 0.72 AR (0.52) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2
SCHEMBL4845510 0.71 AR (0.51) ARPIK3CDPIK3CAPIK3CBSMN1; SMN2

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-2023164237-A1 COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS AGIOS PHARMACEUTICALS, INC. (US) 2023-08-31 WO disclosed