SCHEMBL6208872

SCHEMBL6208872

O=C(O)NC1C(=O)Nc2ccccc2S[C@H]1c1cc(F)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
GLA P06280 1/20 0.44
USP2 O75604 1/20 0.44
ESR1 P03372 1/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
PTPN7 P35236 1/20 0.44
RECQL P46063 1/20 0.44
ESR2 Q92731 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
HTT P42858 3/20 0.41
TSHR P16473 1/20 0.40
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39

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
SCHEMBL6208869 1.00 HSD17B10 (0.44) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL3343392 0.87 FPR1 (0.36) HSD17B10TDP1POLBHTTMAPT
SCHEMBL3343384 0.87 FPR1 (0.36) HSD17B10TDP1POLBHTTMAPT
SCHEMBL3347461 0.85 IDO1 (0.43) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL4112461 0.85 IDO1 (0.43) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL3347473 0.85 IDO1 (0.43) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL4112458 0.85 IDO1 (0.43) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL3347463 0.85 IDO1 (0.43) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL3343593 0.79 HSD17B10 (0.44) HSD17B10TDP1KDM4EPOLBGLA
SCHEMBL3343602 0.79 HSD17B10 (0.44) HSD17B10TDP1KDM4EPOLBGLA

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
EP-1554250-A1 NOVEL LACTAMS AND USES THEREOF AstraZeneca AB (SE) 2005-07-20 EP disclosed
WO-2004031154-A1 NOVEL LACTAMS AND USES THEREOF ASTRAZENECA AB (SE) 2004-04-15 WO disclosed