SCHEMBL8338349

SCHEMBL8338349

CCCCC(CC(C)c1cc(C)ccc1C)NC(=O)Nc1c(SC)cc(C)nc1SC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 6/20 0.35
▸ TAS1R3 Q7RTX0 3/20 0.34
▸ TAS1R1 Q7RTX1 3/20 0.34
▸ PYGL P06737 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ KCNH2 Q12809 2/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL8343999 0.91 SOAT1 (0.38) SOAT1TAS1R3TAS1R1PYGLCYP2C9
SCHEMBL8523783 0.86 SOAT1 (0.39) SOAT1PYGLCYP2C9KMT2AMAPK1
SCHEMBL8343766 0.83 TAS1R3 (0.38) SOAT1TAS1R3TAS1R1CYP2C9KMT2A
SCHEMBL8338762 0.83 FPR1 (0.34) SOAT1
SCHEMBL8344851 0.82 SOAT1 (0.38) SOAT1TAS1R3TAS1R1NPSR1L3MBTL1
SCHEMBL8339156 0.81 SOAT1 (0.38) SOAT1TAS1R3TAS1R1PYGLCYP2C9
SCHEMBL8338705 0.79 SOAT1 (0.37) SOAT1PYGL
SCHEMBL8344880 0.79 SOAT1 (0.37) SOAT1
SCHEMBL8338312 0.78 SOAT1 (0.37) SOAT1PYGLCYP2C9
SCHEMBL8344370 0.76 SOAT1 (0.37) SOAT1KMT2ANPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
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