SCHEMBL8343254

SCHEMBL8343254

CCSc1cc(C)nc(SCC)c1NC(=O)NCC(CCCC(F)(F)F)c1cc(C)ccc1C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PYGL P06737 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL8338963 0.90 EPHX2 (0.34) NPSR1L3MBTL1PYGLMAPTLMNA
SCHEMBL8343577 0.90 MAPT (0.33) NPSR1L3MBTL1MAPTLMNATP53
SCHEMBL8341157 0.90 EPHX2 (0.36) NPSR1L3MBTL1MAPT
SCHEMBL8341289 0.88 MAPT (0.34) NPSR1L3MBTL1PYGLMAPTLMNA
SCHEMBL8343733 0.86 KMT2A (0.38) MAPTLMNATP53POLBRXFP1
SCHEMBL7771363 0.86 KMT2A (0.39) MAPTLMNATP53POLBRXFP1
SCHEMBL8344851 0.79 SOAT1 (0.38) NPSR1L3MBTL1MAPTLMNA
SCHEMBL8338705 0.79 SOAT1 (0.37) PYGLMAPT
SCHEMBL8340874 0.78 TP53 (0.31) MAPTTP53
SCHEMBL8344880 0.78 SOAT1 (0.37) MAPT

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-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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