SCHEMBL7795870

SCHEMBL7795870

CCCCCCCCS(=O)(=O)Nc1ccc2[nH]c(C(=O)SCCCCCSC(=O)c3nc4cc(NS(=O)(=O)CCCCCCCC)ccc4[nH]3)nc2c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.42
SGK1 O00141 1/20 0.40
THRA P10827 1/20 0.39
KIT P10721 2/20 0.38
HPGD P15428 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
PTPN5 P54829 1/20 0.36

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
SCHEMBL7795873 0.92 GRIN1 (0.42) BRD4SGK1THRAKITHPGD
SCHEMBL7792322 0.85 MMP2 (0.42) BRD4GRIN1GRIN2B
SCHEMBL7792625 0.82 SPHK2 (0.48) HPGDKDM4EALDH1A1HSD17B10LMNA
SCHEMBL7792259 0.79 MEN1 (0.43) HPGDKDM4EALDH1A1HSD17B10MEN1
SCHEMBL7792301 0.79 BRD4 (0.48) BRD4SGK1THRAKITHPGD
SCHEMBL7792325 0.77 GRIN1 (0.44) ALDH1A1MEN1LMNAKMT2AGRIN1
SCHEMBL7792319 0.74 PIN1 (0.47) HPGDKDM4EALDH1A1HSD17B10MEN1
SCHEMBL7792628 0.73 SPHK2 (0.48) HPGDKDM4EALDH1A1HSD17B10LMNA
SCHEMBL7792095 0.73 CA2 (0.36) ALDH1A1HSD17B10
SCHEMBL7796104 0.72 HPGD (0.39) BRD4SGK1THRAHPGDKDM4E

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-0742210-B1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2001-11-21 EP disclosed
US-5962493-A HYPOLIPEMIC AGENTS; ANTICHOLESTEROL AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1999-10-05 US disclosed
EP-0742210-A1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 1996-11-13 EP disclosed