SCHEMBL9680770

SCHEMBL9680770

CC(C)c1cccc(C(C)C)c1NC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
KMT2A Q03164 1/20 0.62
CTSL P07711 4/20 0.58
CTSS P25774 2/20 0.58
CTSK P43235 2/20 0.58
PSMB5 P28074 2/20 0.56
SOAT2 O75908 1/20 0.55
SOAT1 P35610 1/20 0.55
USP30 Q70CQ3 4/20 0.54
CTSB P07858 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL9679315 0.88 SOAT2 (0.59) LMNAKMT2ASOAT2SOAT1L3MBTL1
SCHEMBL9679311 0.88 SOAT2 (0.59) LMNAKMT2ASOAT2SOAT1L3MBTL1
SCHEMBL9679677 0.87 SOAT2 (0.57) LMNAKMT2ACTSSCTSKSOAT2
SCHEMBL16999513 0.86 USP30 (0.58) CTSLCTSSCTSKPSMB5USP30
SCHEMBL9681111 0.83 SOAT2 (0.53) LMNAKMT2ACTSLSOAT2SOAT1
SCHEMBL9680183 0.83 ANPEP (0.63) PSMB5SOAT2SOAT1L3MBTL1
SCHEMBL9679723 0.82 SOAT2 (0.57) LMNAKMT2APSMB5SOAT2SOAT1
SCHEMBL9851026 0.82 CTSL (0.61) CTSLCTSSCTSKCTSB
SCHEMBL9681008 0.81 PSMB5 (0.59) PSMB5SOAT2SOAT1CTSB
SCHEMBL9678920 0.80 SOAT2 (0.53) PSMB5SOAT2SOAT1

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-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP claimed
US-5153226-A Administering as anticholesterol agents, for atherosclerosis WARNER-LAMBERT COMPANY (US) 1992-10-06 US disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP disclosed