SCHEMBL9848428

SCHEMBL9848428

CC(C)c1cccc(C(C)C)c1NC(=O)NCCc1ccccc1NCc1ccc(N(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.50
ACAT1 P24752 1/20 0.50
SOAT1 P35610 1/20 0.50
CNR1 P21554 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
LPAR1 Q92633 1/20 0.41

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
SCHEMBL855763 0.74 GAA (0.50)
SCHEMBL9513684 0.73 EPHX1 (0.63) SOAT2SOAT1
SCHEMBL9513440 0.73 MTNR1A (0.64)
SCHEMBL9514663 0.71 CES2 (0.62) TRPV1
SCHEMBL9679385 0.71 KMT2A (0.55) SOAT2ACAT1SOAT1
SCHEMBL9848424 0.71 SOAT2 (0.48) SOAT2ACAT1SOAT1
SCHEMBL9514688 0.69 KDM4E (0.61) CNR1
SCHEMBL9680238 0.68 SOAT2 (0.52) SOAT2SOAT1
SCHEMBL9192380 0.68 SOAT1 (0.69) SOAT2ACAT1SOAT1
SCHEMBL9558623 0.68 LPAR1 (0.55) LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0432442-A1 ACAT inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-19 EP claimed
EP-0432442-A1 ACAT inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-19 EP disclosed