SCHEMBL9680211

SCHEMBL9680211

CC(C)c1cccc(C(C)C)c1NC(=O)CN(Cc1ccccc1)C(=O)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 2/20 0.52
SOAT1 P35610 2/20 0.52
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL9681145 0.85 SOAT2 (0.56) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9678665 0.85 KMT2A (0.47) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9680204 0.83 SOAT2 (0.51) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL6899771 0.83 SOAT1 (0.62) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9679390 0.82 ALDH1A1 (0.58) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9679857 0.82 SOAT2 (0.57) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9679656 0.81 SOAT2 (0.60) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL9463360 0.80 SOAT2 (0.55) SOAT2SOAT1KMT2AMEN1LMNA
SCHEMBL11143056 0.79 ALDH1A1 (0.58) SOAT2SOAT1KMT2ALMNASMN1; SMN2
SCHEMBL9844078 0.78 SOAT1 (0.56) SOAT2SOAT1KMT2AMEN1LMNA

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
US-5153226-A Administering as anticholesterol agents, for atherosclerosis WARNER-LAMBERT COMPANY (US) 1992-10-06 US disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP disclosed