SCHEMBL9640366

SCHEMBL9640366

Cc1cccc(C(C)C)c1NC(=O)NC1(c2cccs2)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.41
SOAT2 O75908 1/20 0.39
ACAT1 P24752 1/20 0.39
SOAT1 P35610 1/20 0.39
NLRP3 Q96P20 1/20 0.39
EPHX1 P07099 1/20 0.39
SLC6A4 P31645 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MEN1 O00255 2/20 0.38

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
SCHEMBL9641290 0.90 LMNA (0.52) LMNAMAPTALOX15HTTRAB9A
SCHEMBL9641583 0.83 LMNA (0.43) LMNAMAPTALOX15HTTRAB9A
SCHEMBL9641234 0.79 HDAC3 (0.42) LMNASLC6A4HDAC3HDAC1HDAC2
SCHEMBL9640387 0.70 HDAC3 (0.51) LMNARAB9ASLC6A4HDAC3HDAC1
SCHEMBL9640371 0.70 SOAT1 (0.67) LMNAMAPTSOAT2ACAT1SOAT1
SCHEMBL9194196 0.69 EPHX1 (0.47) LMNAHTTEPHX1PKM
SCHEMBL9269484 0.69 SMN1; SMN2 (0.43) LMNAMAPTALOX15HTTRAB9A
SCHEMBL9640319 0.68 SOAT1 (0.68) LMNAMAPTMAPK1SOAT2ACAT1
SCHEMBL9640296 0.68 RAB9A (0.56) LMNAMAPTHTTRAB9AMEN1
SCHEMBL21916840 0.68 SLC6A4 (0.58) LMNAHTTSLC6A4HDAC3HDAC1

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-0293880-B1 ANTIHYPERLIPIDEMIC AND ANTIATHEROSCLEROTIC UREA COMPOUNDS WARNER-LAMBERT COMPANY (US) 1992-08-26 EP claimed
EP-0293880-B1 ANTIHYPERLIPIDEMIC AND ANTIATHEROSCLEROTIC UREA COMPOUNDS WARNER-LAMBERT COMPANY (US) 1992-08-26 EP disclosed
US-5015644-A Antihyperlipidemic and antiatherosclerotic urea and carbamate compounds WARNER-LAMBERT COMPANY (US) 1991-05-14 US disclosed