SCHEMBL8962577

SCHEMBL8962577

CC(C)c1cccc(C(C)C)c1NS(=O)(=O)CC(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SOAT2 O75908 1/20 0.41
SOAT1 P35610 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL8962535 0.81 SMN1; SMN2 (0.60) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL8962380 0.81 LMNA (0.47) KMT2ALMNASMN1; SMN2
SCHEMBL9844414 0.79 SOAT1 (0.58) TSHRKMT2AMEN1LMNASMN1; SMN2
SCHEMBL8941187 0.79 TSHR (0.48) TSHRSOAT2SOAT1
SCHEMBL7567348 0.78
SCHEMBL8121753 0.78 TSHR (0.55) TSHRKMT2AMEN1LMNAL3MBTL1
SCHEMBL8962531 0.78 SMN1; SMN2 (0.47) KMT2ALMNASMN1; SMN2
SCHEMBL8962536 0.76 SOAT1 (0.44) KMT2ALMNASMN1; SMN2SOAT1
SCHEMBL9390816 0.76 SMN1; SMN2 (0.50) KMT2ALMNASMN1; SMN2
SCHEMBL8962419 0.76 MEN1 (0.51) KMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996019446-A1 β-CARBOXY SULFONAMIDE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO claimed
WO-1996019446-A1 β-CARBOXY SULFONAMIDE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO disclosed
US-5491170-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1996-02-13 US disclosed