SCHEMBL9724100

SCHEMBL9724100

ONCc1ccc(Sc2cccc(Cl)c2)s1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
PKM P14618 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 2/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP7 Q93009 1/20 0.36
HSD17B1 P14061 2/20 0.35
HSD17B2 P37059 2/20 0.35
TP53 P04637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
RHEB Q15382 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
LMNA P02545 1/20 0.32
FBP1 P09467 1/20 0.32

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
SCHEMBL9724167 0.86 KDM4E (0.46) KDM4EPKML3MBTL1POLBSLC6A2
SCHEMBL9724093 0.82 MEN1 (0.33) L3MBTL1POLBMEN1KMT2AALDH1A1
SCHEMBL9724109 0.82 THRB (0.39) KDM4EPKML3MBTL1POLBMEN1
SCHEMBL9724116 0.80 ALDH1A1 (0.40) KDM4EL3MBTL1POLBSLC6A2SLC6A4
SCHEMBL9724082 0.74 ALOX5 (0.43) KDM4EPKML3MBTL1POLBSLC6A2
SCHEMBL9724126 0.74 KDM4E (0.47) KDM4EPKML3MBTL1POLBUSP7
SCHEMBL9724161 0.72 KDM4E (0.46) KDM4EPKML3MBTL1POLBSLC6A2
SCHEMBL9724113 0.72 KDM4E (0.41) KDM4EPKML3MBTL1POLBSLC6A2
SCHEMBL11392906 0.71 HSD17B1 (0.52) KDM4EPKML3MBTL1POLBMEN1
SCHEMBL11521691 0.70 L3MBTL1 (0.68) KDM4EPKML3MBTL1POLBSLC6A2

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