SCHEMBL9724080

SCHEMBL9724080

O=Cc1ccc(Sc2cccc(Cl)c2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
PKM P14618 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TERT O14746 1/20 0.39
USP7 Q93009 1/20 0.38
HSD17B1 P14061 2/20 0.38
HSD17B2 P37059 2/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
NOTUM Q6P988 1/20 0.36
RHEB Q15382 1/20 0.36
POLB P06746 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CYP2A6 P11509 1/20 0.34
FBP1 P09467 1/20 0.34
EGFR P00533 1/20 0.34

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
SCHEMBL6489008 0.80 MAPT (0.39) L3MBTL1TERTUSP7MEN1KMT2A
SCHEMBL9373023 0.80 APP (0.38) KDM4EPKML3MBTL1HSD17B1HSD17B2
SCHEMBL9724142 0.79 ALDH1A1 (0.39) KDM4EPKML3MBTL1TERTUSP7
SCHEMBL9724087 0.78 NOTUM (0.40) KDM4EHPGDKMT2ANOTUMPOLB
SCHEMBL17398498 0.77 RHEB (0.41) KDM4EPKML3MBTL1TERTUSP7
SCHEMBL17398433 0.75 SLC6A2 (0.42) KDM4EPKML3MBTL1TERTUSP7
SCHEMBL11392906 0.74 HSD17B1 (0.52) KDM4EPKML3MBTL1USP7HSD17B1
SCHEMBL11521691 0.73 L3MBTL1 (0.68) KDM4EPKML3MBTL1USP7HSD17B1
SCHEMBL5804507 0.73 CA2 (0.49) KDM4EPKML3MBTL1MEN1ALDH1A1
SCHEMBL9724133 0.73 USP7 (0.60) KDM4EPKML3MBTL1USP7HSD17B1

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