SCHEMBL6780908

SCHEMBL6780908

CC(C)c1cccc(C(C)C)c1NC(=O)CCCCCCCCCSc1nc2ccccc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.71
SMN1; SMN2 Q16637 3/20 0.71
SOAT1 P35610 2/20 0.67
POLB P06746 1/20 0.65
NPC1 O15118 1/20 0.64
HTT P42858 1/20 0.64
RECQL P46063 1/20 0.64
RAB9A P51151 1/20 0.64

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
SCHEMBL6273235 1.00 LMNA (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6276242 1.00 LMNA (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6273825 1.00 LMNA (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6275012 1.00 LMNA (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6268668 1.00 LMNA (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6268678 0.99 LMNA (0.72) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6270942 0.97 LMNA (0.75) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6274968 0.94 LMNA (0.78) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6269160 0.92 SOAT1 (0.71) LMNASMN1; SMN2SOAT1POLBNPC1
SCHEMBL6214846 0.88 LMNA (0.55) LMNASMN1; SMN2SOAT1

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
US-6825223-B2 ACYL COENZYME A CHOLESTEROL ACYLTRANSFERASE (ACAT) INHIBITORS; 2-SUBSTITUTED BENZIMIDAZOLE, BENZOXAZOLE, AND BENZOTHIAZOLES KOWA COMPANY, LTD. (JP) 2004-11-30 US disclosed
US-6204278-B1 Anilide compounds, including use thereof in ACAT inhibitition KOWA COMPANY, LTD. (JP) 2001-03-20 US disclosed
EP-0807627-A2 Anilide compounds as ACAT inhibitors Kowa Company Ltd. (JP) 1997-11-19 EP disclosed