SCHEMBL8555551

SCHEMBL8555551

O=S(=O)(Nc1nc(Cc2ccccc2)oc1-c1cc(F)cc(F)c1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
ALDH1A1 P00352 4/20 0.43
SLC40A1 Q9NP59 1/20 0.43
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
LIMK2 P53671 1/20 0.39
PPARG P37231 1/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 6/20 0.38
RXFP1 Q9HBX9 3/20 0.38
GAA P10253 1/20 0.38
PTPN1 P18031 3/20 0.38
PTPN5 P54829 3/20 0.38
PTPN2 P17706 2/20 0.38
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 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
SCHEMBL8556998 0.91 PTPN1 (0.44) MAPTALDH1A1SLC40A1LIMK2KDM4E
SCHEMBL8559708 0.90 MAPT (0.46) MAPTALDH1A1LIMK2KDM4ERXFP1
SCHEMBL8557471 0.88 MAPT (0.48) MAPTALDH1A1LIMK2TSHRKDM4E
SCHEMBL8554941 0.87 MAPT (0.41) MAPTALDH1A1SLC40A1LIMK2PPARG
SCHEMBL8556039 0.86 MAPT (0.44) MAPTALDH1A1SLC40A1RXRARXRB
SCHEMBL8557996 0.86 MAPT (0.46) MAPTALDH1A1SLC40A1RXRARXRB
SCHEMBL8558562 0.86 MAPT (0.43) MAPTALDH1A1SLC40A1LIMK2TSHR
SCHEMBL8559236 0.84 KMT2A (0.47) MAPTALDH1A1LIMK2TSHRKDM4E
SCHEMBL8561140 0.84 MAPT (0.41) MAPTALDH1A1SLC40A1TSHRKDM4E
SCHEMBL8561648 0.84 PIK3CD (0.46) MAPTALDH1A1SLC40A1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed