SCHEMBL9463141

SCHEMBL9463141

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

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.70
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
TDP1 Q9NUW8 1/20 0.59
SOAT1 P35610 3/20 0.56
SOAT2 O75908 2/20 0.56
LMNA P02545 1/20 0.56
NLRP3 Q96P20 1/20 0.50
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL9843936 0.87 SMN1; SMN2 (0.77) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL9463095 0.84 SMN1; SMN2 (0.72) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL190379 0.82 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL2148218 0.82 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL3408925 0.82 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL6213287 0.81 SOAT1 (0.60) SMN1; SMN2SOAT1
Benzene SCHEMBL9851028 0.81 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL8819876 0.79 KMT2A (0.61) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL5974257 0.79 SMN1; SMN2 (0.66) SMN1; SMN2KMT2AMEN1TDP1SOAT1
SCHEMBL20763994 0.79 SMN1; SMN2 (0.66) SMN1; SMN2KMT2AMEN1TDP1SOAT1

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-5208224-A Phosphorus containing compounds as antihypercholesterolemic and antiatherosclerotic agents WARNER-LAMBERT COMPANY (US) 1993-05-04 US disclosed