SCHEMBL8559301

SCHEMBL8559301

O=S(=O)(Nc1oc(C2CCCCC2)nc1-c1ccc(F)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MAPT P10636 3/20 0.43
NPC1 O15118 2/20 0.43
KIT P10721 1/20 0.43
ATM Q13315 1/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPN2 P17706 2/20 0.40
PTPN1 P18031 2/20 0.40
PTPN5 P54829 2/20 0.40
HSPD1 P10809 1/20 0.40
HSPE1 P61604 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 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
SCHEMBL8555819 0.81 MAPT (0.40) KMT2AMAPTATMKDM4EPTPN2
SCHEMBL8560329 0.79 PTGS2 (0.52) KMT2AMAPTKDM4EPTPN2PTPN1
SCHEMBL8560089 0.78 MAPT (0.58) KMT2AMAPTKDM4ELMNAHSD17B10
SCHEMBL8559926 0.75 MAPT (0.47) KMT2AMAPTLMNAHSD17B10PTPN2
SCHEMBL8556139 0.75 MAPT (0.47) KMT2AMAPTPTPN2PTPN1PTPN5
SCHEMBL8558820 0.75 MAPT (0.47) KMT2AMAPTHSD17B10PTPN2PTPN1
SCHEMBL8557761 0.74 MAPT (0.49) KMT2AMAPTLMNAPTPN2PTPN1
SCHEMBL8560966 0.74 AR (0.48) KMT2AMAPTPTPN2PTPN1PTPN5
SCHEMBL8558401 0.73 MAPT (0.45) KMT2AMAPTPTPN2PTPN1PTPN5
SCHEMBL8558727 0.73 MAPT (0.45) KMT2AMAPTPTPN2PTPN1PTPN5

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