SCHEMBL9679677

SCHEMBL9679677

CC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 2/20 0.57
SOAT1 P35610 2/20 0.57
CTSS P25774 1/20 0.56
CTSK P43235 1/20 0.56
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
GNPAT O15228 1/20 0.50
PAM P19021 1/20 0.50
PSMB8 P28062 1/20 0.47

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 0.91 SOAT2 (0.59) SOAT2SOAT1LMNAKMT2A
SCHEMBL9679311 0.91 SOAT2 (0.59) SOAT2SOAT1LMNAKMT2A
SCHEMBL9680770 0.87 LMNA (0.62) SOAT2SOAT1CTSSCTSKLMNA
SCHEMBL9680183 0.85 ANPEP (0.63) SOAT2SOAT1
SCHEMBL9681111 0.85 SOAT2 (0.53) SOAT2SOAT1LMNAKMT2A
SCHEMBL9679723 0.84 SOAT2 (0.57) SOAT2SOAT1LMNAKMT2A
SCHEMBL9851026 0.84 CTSL (0.61) CTSSCTSK
SCHEMBL9678826 0.84 CTSS (0.59) CTSSCTSKGNPATPAMPSMB8
SCHEMBL9681008 0.83 PSMB5 (0.59) SOAT2SOAT1
SCHEMBL9679671 0.83 CTSS (0.58) CTSSCTSKGNPATPAMPSMB8

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