SCHEMBL11255765

SCHEMBL11255765

CC(=O)OC(COc1ccc(Cl)cc1)C(=O)NC(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 1/20 0.42
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR88 Q9GZN0 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL11258444 0.86 MTNR1A (0.56) PPARGPPARAMTNR1AMTNR1BMAOA
SCHEMBL11273321 0.81 PPARG (0.64) PPARGPPARAMEN1ALDH1A1RAB9A
SCHEMBL11265752 0.80 MEN1 (0.49) PPARGPPARAMEN1ALDH1A1RAB9A
SCHEMBL11270729 0.78 LMNA (0.43) MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL8248742 0.72 SMN1; SMN2 (0.64) MEN1ALDH1A1RAB9AKMT2ASMN1; SMN2
Chlorobenzene SCHEMBL11183837 0.71 MTNR1A (0.51) PPARGPPARAMEN1ALDH1A1RAB9A
SCHEMBL11444385 0.71 CYP1A2 (0.48) PPARGPPARAMEN1ALDH1A1RAB9A
SCHEMBL22605301 0.69 TSHR (0.39) MEN1ALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL7447565 0.68 CYP1A2 (0.51) PPARGPPARAMEN1ALDH1A1RAB9A
SCHEMBL28619870 0.68 PPARA (0.58) PPARGPPARAMEN1ALDH1A1RAB9A

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-4332959-A STARTING WITH PHENOXYACETALDEHYDE AND ALKALI METAL CYANIDE SUCRERIES DU SOISSONNAIS ET COMPAGNIE SUCRIERE (FR) 1982-06-01 US disclosed