SCHEMBL11039876

SCHEMBL11039876

CCOC(=N)C(O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.50
PNMT P11086 1/20 0.50
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
ACP3 P15309 2/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM3 P20309 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX12 P18054 1/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 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
SCHEMBL10583768 0.82 CES2 (0.44) CES2PNMTACP3THRBSMN1; SMN2
Hydrochloric Acid SCHEMBL10386368 0.81 EPHX1 (0.44) CES2PNMTIDO1TDO2ACP3
Hydrochloric Acid SCHEMBL11040499 0.79 CES2 (0.45) CES2IDO1TDO2MAPTMEN1
Hydrochloric Acid SCHEMBL11040287 0.77 BRD4 (0.39) GAAMAPTSLC6A2SLC6A4
SCHEMBL30836057 0.77 CES2 (0.49) CES2PNMTACP3THRBSMN1; SMN2
SCHEMBL1043810 0.77 CES2 (0.49) CES2PNMTACP3THRBSMN1; SMN2
SCHEMBL11044871 0.76 LMNA (0.45) GAAALDH1A1POLBHPGD
SCHEMBL16024763 0.75 CES2 (0.48) CES2PNMTACP3THRBSMN1; SMN2
SCHEMBL3964941 0.75 SMN1; SMN2 (0.48) CES2PNMTACP3THRBSMN1; SMN2
Hydrochloric Acid SCHEMBL11041992 0.75 LMNA (0.44) GAAALDH1A1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4448971-A Hypoglycemic 5-phenyl-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1984-05-15 US disclosed
US-4407811-A Hypoglycemic 5-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1983-10-04 US disclosed
US-4399296-A TRIMETHYLSILYL CYANOHYDRIN INTERMEDIATES PFIZER INC. (US) 1983-08-16 US disclosed
US-4367234-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1983-01-04 US disclosed