SCHEMBL8345291

SCHEMBL8345291

CSc1cc(C)nc(SC)c1NC(=O)N(Cc1ccc2ccccc2c1)C1Cc2ccccc2C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.40
SLC6A4 P31645 5/20 0.40
SLC6A3 Q01959 4/20 0.40
SOAT1 P35610 6/20 0.39
KCNH2 Q12809 2/20 0.39
MC4R P32245 1/20 0.38
MC5R P33032 1/20 0.38
MC3R P41968 1/20 0.38
GCGR P47871 2/20 0.36
UBE2M P61081 2/20 0.36
DCUN1D1 Q96GG9 2/20 0.36
MAPK8 P45983 1/20 0.34
GSK3A P49840 1/20 0.34
MAPK10 P53779 1/20 0.34
HIPK1 Q86Z02 1/20 0.34
RIOK2 Q9BVS4 1/20 0.34
SNRK Q9NRH2 1/20 0.34
MME P08473 1/20 0.33
ACE P12821 1/20 0.33

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
SCHEMBL8339190 0.90 UBE2M (0.39) SOAT1GCGRUBE2MDCUN1D1
SCHEMBL8338160 0.89 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3SOAT1KCNH2
SCHEMBL8345061 0.86 GCGR (0.39) SOAT1GCGRUBE2MDCUN1D1
SCHEMBL8345310 0.85 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3SOAT1KCNH2
SCHEMBL8343693 0.85 SOAT1 (0.40) SOAT1GCGRUBE2MDCUN1D1
SCHEMBL8343988 0.85 SOAT1 (0.39) SLC6A2SLC6A4SOAT1
SCHEMBL8339018 0.85 SOAT1 (0.40) SOAT1GCGR
SCHEMBL8341500 0.84 SOAT1 (0.39) SLC6A2SLC6A4SOAT1GCGR
SCHEMBL8341533 0.84 SOAT1 (0.39) SLC6A2SLC6A4SOAT1
SCHEMBL8341091 0.82 SOAT1 (0.38) SLC6A2SLC6A4SLC6A3SOAT1KCNH2

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 5 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
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 disclosed
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 disclosed