SCHEMBL9691687

SCHEMBL9691687

C/C=C(\CC)C(O)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA14 Q9ULX7 2/20 0.34
ZDHHC7 Q9NXF8 1/20 0.33
ABCB1 P08183 1/20 0.33
CA12 O43570 1/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 2/20 0.32
KMT2A Q03164 2/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
MIF P14174 1/20 0.30

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
SCHEMBL9691693 1.00 SMN1; SMN2 (0.37) SMN1; SMN2CA1CA2CA14ZDHHC7
SCHEMBL9837217 0.80 CYP3A4 (0.37) SMN1; SMN2CA1CA2CA14ZDHHC7
SCHEMBL9834930 0.80 CA1 (0.43) CA1CA2ZDHHC7ABCB1MEN1
SCHEMBL9837221 0.80 CYP3A4 (0.37) SMN1; SMN2CA1CA2CA14ZDHHC7
SCHEMBL9834925 0.80 CA1 (0.43) CA1CA2ZDHHC7ABCB1MEN1
SCHEMBL5411165 0.72 SMN1; SMN2 (0.50) SMN1; SMN2CA1CA2CA14ZDHHC7
SCHEMBL2044096 0.71 CA1 (0.36) SMN1; SMN2CA1CA2CA14ZDHHC7
SCHEMBL27730937 0.70 MGAM (0.46) SMN1; SMN2CA1CA2ZDHHC7TSHR
SCHEMBL9836699 0.70 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2CA14CA12
SCHEMBL9836702 0.70 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2CA14CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153692-B1 METHOD FOR ISOMERIZATION A GLYCIDATE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed
US-4621150-A METAL PERHALATE OR SULFONATE OR COMPLEX; GLYCIDATE, 2-HYDROXY-3-BUTENOATE, EPOXIDE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-11-04 US disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP disclosed