SCHEMBL8779219

SCHEMBL8779219

CC(C)Oc1ccc(O)c(OC(=O)NC(=O)CN)n1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 13/20 0.34
ACACA Q13085 3/20 0.33
SYK P43405 1/20 0.33
ALDH1A1 P00352 1/20 0.31
ACHE P22303 1/20 0.31
ADORA2A P29274 1/20 0.30
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8779178 0.85 PRKD3 (0.33) ACACBALDH1A1KDM4EUSP2HPGD
SCHEMBL8779424 0.84 MAPK8 (0.37) ACACBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8779185 0.83 ACACB (0.37) ACACBALDH1A1HPGDHSD17B10
SCHEMBL8779132 0.81 ACACB (0.34) ACACBACACAALDH1A1ADORA2AHSD17B10
SCHEMBL8779357 0.81 GPR88 (0.32)
SCHEMBL8779023 0.81 KDM4E (0.36) KDM4E
SCHEMBL8779296 0.80 MEN1 (0.33) ACACBALDH1A1HPGD
SCHEMBL8882475 0.80 SYK (0.36) ACACBACACASYKADORA2A
SCHEMBL8779309 0.78 L3MBTL1 (0.39) ALDH1A1
SCHEMBL8779211 0.77 MEN1 (0.40) ALDH1A1KDM4EHPGDHSD17B10

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-0661269-B1 Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments HOECHST AG (DE) 1997-03-26 EP disclosed
EP-0661269-A1 Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed