SCHEMBL23948595

SCHEMBL23948595

CCOC(=O)C1(C)CN(c2cc(F)cc(F)c2)C1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.36
CHRM1 P11229 2/20 0.33
ADAMTS5 Q9UNA0 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
F10 P00742 1/20 0.32
ALOX5 P09917 1/20 0.32
GRM5 P41594 1/20 0.32
MMP2 P08253 1/20 0.32
LMNA P02545 1/20 0.32
GLI1 P08151 1/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
XPO1 O14980 1/20 0.32

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
SCHEMBL23948594 0.72 OPRM1 (0.37) OPRM1CHRM1ADAMTS5MEN1KMT2A
SCHEMBL31128660 0.70 ADAMTS5 (0.36) OPRM1ADAMTS5KMT2AGRM5MMP2
SCHEMBL31016569 0.66 FFAR4 (0.40) CHRM1MEN1KMT2ALMNAALDH1A1
SCHEMBL11269738 0.65 ALDH1A1 (0.35) OPRM1MEN1KMT2AALDH1A1XPO1
SCHEMBL29354473 0.64 OPRM1 (0.45) OPRM1MEN1KMT2AF10LMNA
SCHEMBL16455156 0.64 OPRM1 (0.45) OPRM1MEN1KMT2AF10LMNA
SCHEMBL9660794 0.63 F10 (0.39) F10LMNAALDH1A1
SCHEMBL12919611 0.63 F10 (0.42) OPRM1F10LMNAGLI1OPRD1
SCHEMBL25854727 0.61 MEN1 (0.41) OPRM1MEN1KMT2AF10ALOX5
SCHEMBL18071114 0.61 F10 (0.40) MEN1KMT2AF10LMNAALDH1A1

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-2021209268-A1 BETA-LACTAMS AND THEIR USE AS HERBICIDES BASF SE (DE) 2021-10-21 WO disclosed