SCHEMBL3360045

SCHEMBL3360045

COC(=O)N(C)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 5/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
RAB9A P51151 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRM3 P20309 1/20 0.31
CHRNA4 P43681 1/20 0.31

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
SCHEMBL11149946 0.84
SCHEMBL7351142 0.84
SCHEMBL11097023 0.82
SCHEMBL28679715 0.82
Hydrochloric Acid SCHEMBL11685194 0.82 KMT2A (0.36) ALDH1A1MEN1KMT2AHCAR2RAB9A
SCHEMBL23452708 0.82 DGAT1 (0.43)
Hydrochloric Acid SCHEMBL11688297 0.82 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATSHRHSD17B10
SCHEMBL15858866 0.80 ALDH1A1 (0.32) ALDH1A1MEN1KMT2A
SCHEMBL10014036 0.80 NQO1 (0.35) ALDH1A1MEN1KMT2A
SCHEMBL208499 0.79

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
US-20230357467-A1 FLUORINE-CONTAINING COPOLYMER PRODUCTION METHOD AND FLUORINE-CONTAINING COPOLYMER AGC Inc. (JP) 2023-11-09 US disclosed
WO-2019062802-A1 ISOXAZOLINE DERIVATIVES AND THEIR USES IN AGRICULTURE RELATED APPLICATION DONGGUAN HEC TECH R & D CO., LTD. (CN) 2019-04-04 WO disclosed
US-20100124702-A1 High Energy Composite Cathodes for Lithium Ion Batteries PHYSICAL SCIENCES, INC. (US) 2010-05-20 US disclosed