SCHEMBL9724133

SCHEMBL9724133

CC(=O)c1ccc(Sc2cccc(Cl)c2)s1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 8/20 0.60
HSD17B1 P14061 2/20 0.51
HSD17B2 P37059 2/20 0.51
KDM4E B2RXH2 1/20 0.49
PKM P14618 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PADI4 Q9UM07 1/20 0.41
KMT2A Q03164 1/20 0.41
USP47 Q96K76 4/20 0.40
GSK3B P49841 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL11392906 0.87 HSD17B1 (0.52) USP7HSD17B1HSD17B2KDM4EPKM
SCHEMBL7826596 0.81 USP47 (0.52) USP7HSD17B1HSD17B2KDM4EPKM
SCHEMBL9724101 0.79 HSD17B1 (0.48) USP7HSD17B1HSD17B2KDM4EL3MBTL1
SCHEMBL11400591 0.75 PKM (0.51) USP7HSD17B1HSD17B2PKM
SCHEMBL2681213 0.75 USP7 (1.00) USP7PADI4USP47
SCHEMBL9724080 0.73 KDM4E (0.51) USP7HSD17B1HSD17B2KDM4EPKM
SCHEMBL13056224 0.72 LMNA (0.40) USP7HSD17B1HSD17B2KDM4EPKM
SCHEMBL11392956 0.72 HSD17B1 (0.52) HSD17B1HSD17B2PKMPOLBRAB9A
SCHEMBL11521691 0.71 L3MBTL1 (0.68) USP7HSD17B1HSD17B2KDM4EPKM
SCHEMBL9724112 0.71 ALOX5 (0.53)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5158971-A Antiallergens, antiinflammatory agents LILLY INDUSTRIES LIMITED (GB) 1992-10-27 US disclosed
EP-0459748-A2 Thien-2-yl methylurea derivatives as leukotriene inhibitors LILLY INDUSTRIES LIMITED (GB) 1991-12-04 EP disclosed