SCHEMBL6603577

SCHEMBL6603577

c1ccc2[nH]c(SCCCCCCOc3ccncc3)nc2c1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.68
LMNA P02545 6/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
NPC1 O15118 2/20 0.68
TP53 P04637 1/20 0.68
MAPT P10636 4/20 0.62
HTT P42858 4/20 0.62
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
HPGD P15428 1/20 0.62
ALDH1A1 P00352 2/20 0.61
BCHE P06276 1/20 0.58
RAB9A P51151 2/20 0.58
GALR3 O60755 1/20 0.54
STAT3 P40763 1/20 0.54
EPHX2 P34913 1/20 0.53

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
SCHEMBL6605379 1.00 AR (0.68) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL14303261 0.84 BCHE (0.83) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL14303260 0.84 BCHE (0.83) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL6141660 0.84 BCHE (0.83) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL14304387 0.84 BCHE (0.83) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL14304381 0.84 BCHE (0.83) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL6608345 0.83 BCHE (0.63) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL6604484 0.82 BCHE (0.58) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL6603072 0.82 BCHE (0.58) ARLMNASMN1; SMN2NPC1TP53
SCHEMBL6603620 0.82 BCHE (0.58) ARLMNASMN1; SMN2NPC1TP53

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
US-6787561-B1 HYPERLIPIDEMIA, ARTERIOSCLEROSIS; ORAL ADMINISTRATION; SUPPRESSING THE FORMING OF MACROPHAGES FUJI PHOTO FILM CO., LTD. (JP) 2004-09-07 US disclosed
EP-1197493-B1 BENZIMIDAZOLE COMPOUNDS FUJI PHOTO FILM CO LTD (JP) 2004-03-24 EP disclosed
EP-1197493-A1 BENZIMIDAZOLE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2002-04-17 EP disclosed