SCHEMBL8340911

SCHEMBL8340911

CSc1nc(C)nc(SC)c1NC(=O)N(Cc1ccc(CCC(C)C)cc1)C1Cc2ccccc2C1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.42
UBE2M P61081 17/20 0.39
DCUN1D1 Q96GG9 17/20 0.39
HTR2A P28223 1/20 0.37

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
SCHEMBL8341852 0.89 UBE2M (0.42) GCGRUBE2MDCUN1D1
SCHEMBL8345061 0.89 GCGR (0.39) GCGRUBE2MDCUN1D1
SCHEMBL8856113 0.87 UBE2M (0.40) UBE2MDCUN1D1HTR2A
SCHEMBL8344008 0.79 MAPT (0.38) GCGRUBE2MDCUN1D1
SCHEMBL9279576 0.78 HTR2A (0.40) HTR2A
SCHEMBL8339190 0.78 UBE2M (0.39) GCGRUBE2MDCUN1D1
SCHEMBL8341438 0.78 MAPT (0.37) GCGRUBE2MDCUN1D1
SCHEMBL8856219 0.76 UBE2M (0.39) UBE2MDCUN1D1HTR2A
SCHEMBL8856358 0.74 SOAT1 (0.40)
SCHEMBL8345291 0.74 SLC6A2 (0.40) GCGRUBE2MDCUN1D1

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
EP-0642498-A1 NEW $i(N)-ARYL AND $i(N)-HETEROARYLUREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A:CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1995-03-15 EP claimed
WO-1993024458-A1 NEW N-ARYL AND N-HETEROARYLUREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A:CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1993-12-09 WO claimed
US-6001860-A N-aryl and N-heteroarylurea derivatives as inhibitors of acyl coenzyme A: Cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1999-12-14 US disclosed