SCHEMBL9765050

SCHEMBL9765050

CC(C)c1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)CC1(c2ccccc2)CCCC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 5/20 0.51
SOAT2 O75908 3/20 0.51
ACAT1 P24752 1/20 0.51
UBE2M P61081 1/20 0.46
DCUN1D1 Q96GG9 1/20 0.46
NMBR P28336 1/20 0.42
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
PTGES O14684 2/20 0.41
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6803071 0.91 UBE2M (0.46) SOAT1SOAT2ACAT1UBE2MDCUN1D1
SCHEMBL6808919 0.90 SOAT1 (0.50) SOAT1SOAT2ACAT1UBE2MDCUN1D1
SCHEMBL9680743 0.87 SOAT1 (0.51) SOAT1SOAT2ACAT1NMBRKMT2A
SCHEMBL6803622 0.87 NMBR (0.45) SOAT1SOAT2ACAT1UBE2MDCUN1D1
SCHEMBL9765058 0.86 TP53 (0.46) KMT2ALMNAALDH1A1NPSR1SLC6A2
SCHEMBL6807653 0.84 SOAT1 (0.43) SOAT1SOAT2ACAT1UBE2MDCUN1D1
SCHEMBL9765049 0.84 SOAT2 (0.48) SOAT1SOAT2ACAT1
SCHEMBL9765053 0.84 NPSR1 (0.43) KMT2ALMNAALDH1A1NPSR1SLC6A2
SCHEMBL6802078 0.83 SOAT2 (0.40) SOAT1SOAT2ACAT1UBE2MDCUN1D1
SCHEMBL11143056 0.83 ALDH1A1 (0.58) SOAT1SOAT2UBE2MDCUN1D1KMT2A

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
EP-0384320-A1 Antihyperlipidemic and anti-atherosclerotic trisubstituted urea compounds WARNER-LAMBERT COMPANY (US) 1990-08-29 EP claimed
US-4994465-A Antihyperlipidemic and antiatherosclerotic trisubstituted urea compounds WARNER-LAMBERT COMPANY (US) 1991-02-19 US disclosed
EP-0384320-A1 Antihyperlipidemic and anti-atherosclerotic trisubstituted urea compounds WARNER-LAMBERT COMPANY (US) 1990-08-29 EP disclosed