SCHEMBL8560089

SCHEMBL8560089

O=S(=O)(Nc1oc(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
PTPN1 P18031 8/20 0.55
PTPN5 P54829 8/20 0.55
PTPN2 P17706 7/20 0.55
HSPD1 P10809 4/20 0.54
HSPE1 P61604 4/20 0.54
HPGD P15428 4/20 0.49
HSD17B10 Q99714 2/20 0.49
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 1/20 0.47
USP1 O94782 1/20 0.47
USP19 O94966 1/20 0.47
UCHL3 P15374 1/20 0.47

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
SCHEMBL8560329 0.86 PTGS2 (0.52) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8559926 0.81 MAPT (0.47) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8556139 0.81 MAPT (0.47) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8558820 0.81 MAPT (0.47) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8557761 0.81 MAPT (0.49) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8558072 0.80 PTGS2 (0.46) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8558727 0.80 MAPT (0.45) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8558401 0.80 MAPT (0.45) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL5694177 0.80 EDNRB (0.51) MAPTMEN1KMT2APTPN1PTPN5
SCHEMBL8555624 0.80 MAPT (0.58) MAPTMEN1KMT2APTPN1PTPN5

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