SCHEMBL9844236

SCHEMBL9844236

CC(C)c1cccc(C(C)C)c1NC(=O)CC(=O)N(CCO)CCO

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
SOAT1 P35610 3/20 0.51
SOAT2 O75908 2/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 1/20 0.47
NLRP3 Q96P20 1/20 0.46

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
SCHEMBL9844078 0.89 SOAT1 (0.56) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL9843990 0.85 SMN1; SMN2 (0.54) SMN1; SMN2SOAT1
SCHEMBL9844196 0.81 SMN1; SMN2 (0.52) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL9843936 0.81 SMN1; SMN2 (0.77) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL6899771 0.81 SOAT1 (0.62) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL9463095 0.78 SMN1; SMN2 (0.72) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL13328398 0.77 SOAT2 (0.55) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL20763994 0.77 SMN1; SMN2 (0.66) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL6731930 0.77 SMN1; SMN2 (0.57) SMN1; SMN2SOAT1SOAT2KMT2AMEN1
SCHEMBL2148218 0.77 SMN1; SMN2 (0.70) SMN1; SMN2SOAT1SOAT2KMT2AMEN1

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
EP-0433662-A2 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-26 EP claimed