SCHEMBL8554941

SCHEMBL8554941

O=S(=O)(Nc1nc(Cc2ccccc2)oc1-c1ccc(F)c(F)c1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
LIMK2 P53671 3/20 0.40
ADRB3 P13945 1/20 0.40
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
STAT3 P40763 1/20 0.38
PPARG P37231 1/20 0.37
PGR P06401 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
HSPD1 P10809 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN5 P54829 1/20 0.37
HSPE1 P61604 1/20 0.37
TSHR P16473 1/20 0.37
SLC40A1 Q9NP59 2/20 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
SCHEMBL8558562 0.91 MAPT (0.43) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL8559236 0.91 KMT2A (0.47) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL8560735 0.88 PTGS2 (0.43) MAPTALDH1A1LMNATSHRSLC40A1
SCHEMBL8559708 0.88 MAPT (0.46) MAPTALDH1A1LIMK2KMT2AKDM4E
SCHEMBL8556998 0.87 PTPN1 (0.44) MAPTALDH1A1LIMK2KMT2AKDM4E
SCHEMBL8555551 0.87 MAPT (0.43) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL8557471 0.86 MAPT (0.48) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL8560337 0.85 MAPT (0.50) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL9026371 0.85 KMT2A (0.41) MAPTKMT2ATSHRSLC40A1
SCHEMBL8556146 0.85 PGR (0.50) MAPTALDH1A1LMNAPGRKDM4E

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