SCHEMBL8344962

SCHEMBL8344962

CSc1ccc2ncccc2c1NC(=O)NCC1(c2ccc(C)cc2)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SOAT2 O75908 1/20 0.41
▸ ACAT1 P24752 1/20 0.41
▸ SOAT1 P35610 1/20 0.41
▸ P2RX7 Q99572 7/20 0.39
▸ MCHR1 Q99705 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ SLC22A12 Q96S37 1/20 0.36
▸ NMBR P28336 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL8341699 0.99 SOAT2 (0.42) SOAT2ACAT1SOAT1P2RX7MCHR1
SCHEMBL8341689 0.93 P2RX7 (0.46) SOAT2ACAT1SOAT1P2RX7TP53
SCHEMBL8341067 0.92 P2RX7 (0.44) SOAT2ACAT1SOAT1P2RX7TP53
SCHEMBL8338362 0.76 MCHR1 (0.43) SOAT2ACAT1SOAT1P2RX7MCHR1
SCHEMBL8343943 0.75 MCHR1 (0.46) SOAT2ACAT1SOAT1P2RX7MCHR1
SCHEMBL8344110 0.75 MCHR1 (0.44) SOAT2ACAT1SOAT1P2RX7MCHR1
SCHEMBL8344481 0.73 TRPV1 (0.39) HPGD
SCHEMBL8341687 0.72 ALDH1A1 (0.41) LMNA
SCHEMBL8345165 0.71 TP53 (0.46) SOAT2ACAT1SOAT1TP53MEN1
SCHEMBL8340881 0.70 TP53 (0.47) SOAT2ACAT1SOAT1TP53LMNA

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
Send feedback