SCHEMBL7847833

SCHEMBL7847833

CC(=O)OOc1cc(C)ccc1CCl

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 5/20 0.37
HTT P42858 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.36
CYP2C9 P11712 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
KMT2A Q03164 1/20 0.34
SRC P12931 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33

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
SCHEMBL9222602 0.85 LMNA (0.39) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL27298158 0.84 TSHR (0.35) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL7847835 0.83 LMNA (0.48) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL9056553 0.81 HSD17B10 (0.42) ALDH1A1KMT2AHSD17B10
SCHEMBL27345939 0.78 SMN1; SMN2 (0.39) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL27699733 0.78 MRGPRX4 (0.43) LMNASMN1; SMN2ALDH1A1CYP2C9NPSR1
SCHEMBL28714159 0.74 LMNA (0.38) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL7848040 0.74 PTGDR2 (0.54) LMNASMN1; SMN2HTTTSHRKDM4E
SCHEMBL8197650 0.73 LMNA (0.48) LMNASMN1; SMN2HTTALDH1A1TSHR
SCHEMBL9023705 0.73 ACHE (0.56) LMNASMN1; SMN2HTTALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656892-B1 HERBICIDAL 2- (4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORP (US) 2001-06-13 EP disclosed
EP-0656892-A1 HERBICIDAL 2- (4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORPORATION (US) 1995-06-14 EP disclosed