SCHEMBL8344907

SCHEMBL8344907

CCCCCC(CNC(=O)Nc1c(C)cc(C)nc1C)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ HTR1A P08908 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ PKM P14618 2/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MAPK1 P28482 2/20 0.34
▸ LCK P06239 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GPR183 P32249 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
SCHEMBL9211015 0.83 GAA (0.35) POLBGAAHTR1AHTR2CHTR2A
SCHEMBL8338876 0.72 SOAT1 (0.35) PKM
SCHEMBL8340844 0.70 SOAT1 (0.36) PKM
SCHEMBL8344037 0.70 SOAT1 (0.34) LCKALDH1A1
SCHEMBL8339036 0.69 SOAT1 (0.37) LCK
SCHEMBL8340874 0.69 TP53 (0.31) —
SCHEMBL18881030 0.69 PTGS2 (0.44) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL8343571 0.69 EPHX2 (0.34) LCK
SCHEMBL8341668 0.68 EPHX2 (0.35) LCK
SCHEMBL8338866 0.67 SOAT1 (0.41) ALDH1A1

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
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
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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