SCHEMBL6604233

SCHEMBL6604233

Clc1ccc2nc(SCCCCCOc3ccccn3)[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
LMNA P02545 5/20 0.54
HTT P42858 3/20 0.54
AR P10275 2/20 0.50
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP1A2 P05177 8/20 0.47
CYP2E1 P05181 8/20 0.47
CYP3A4 P08684 8/20 0.47
CYP2C8 P10632 8/20 0.47
CYP2D6 P10635 8/20 0.47
CYP2C9 P11712 8/20 0.47
CYP2B6 P20813 8/20 0.47
CYP2C19 P33261 8/20 0.47
METAP2 P50579 1/20 0.46
METAP1 P53582 1/20 0.46
CBFB Q13951 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45

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
SCHEMBL6604228 0.91 AR (0.50) MAPTLMNAHTTARRAB9A
SCHEMBL6603957 0.88 LMNA (0.50) MAPTLMNAHTTARRAB9A
SCHEMBL6604521 0.87 LMNA (0.72) MAPTLMNAHTTARRAB9A
SCHEMBL6604484 0.86 BCHE (0.58) MAPTLMNAHTTARRAB9A
SCHEMBL6603072 0.86 BCHE (0.58) MAPTLMNAHTTARRAB9A
SCHEMBL6603620 0.86 BCHE (0.58) MAPTLMNAHTTARRAB9A
SCHEMBL6604274 0.86 BCHE (0.58) MAPTLMNAHTTARRAB9A
SCHEMBL6604371 0.85 CYP2E1 (0.67) MAPTLMNAHTTCYP1A2CYP2E1
SCHEMBL6608159 0.85 BCHE (0.60) MAPTLMNAHTTARRAB9A
SCHEMBL14304934 0.83 RAB9A (0.63) MAPTLMNAHTTRAB9AHSD17B10

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