SCHEMBL10546403

SCHEMBL10546403

CCCCOC(C)N1CC(C)OC1=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GRM2 Q14416 12/20 0.35
THRA P10827 1/20 0.32
THRB P10828 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
SCHEMBL8865845 0.91 GRM2 (0.34) SMN1; SMN2HPGDALDH1A1GRM2
SCHEMBL10545641 0.84 GRM2 (0.38) GRM2
SCHEMBL10549013 0.84 SMN1; SMN2 (0.39) SMN1; SMN2HPGDALDH1A1GRM2
SCHEMBL8867264 0.76 GRM2 (0.36) SMN1; SMN2GRM2
SCHEMBL10548107 0.74 GRM2 (0.36) SMN1; SMN2GRM2
SCHEMBL10550159 0.73 NAAA (0.41) SMN1; SMN2HPGDALDH1A1THRATHRB
SCHEMBL13330256 0.73 TSHR (0.38) GRM2
SCHEMBL10308830 0.71 HTR2B (0.38) SMN1; SMN2GRM2
SCHEMBL13765689 0.71 GRM2 (0.36) SMN1; SMN2GRM2
SCHEMBL6551798 0.69 GRM2 (0.34) SMN1; SMN2GRM2

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
US-4831153-A PYROLYZING (N-(1-HYDROXYALKYL) OR N-(1-HYDROCARBYLOXYALKYL))-2-OXAZOLIDINONE THE DOW CHEMICAL COMPANY (US) 1989-05-16 US disclosed