SCHEMBL8478164

SCHEMBL8478164

CCc1noc(NS(=O)(=O)c2ccccc2)c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.49
EDNRB P24530 7/20 0.46
EDNRA P25101 7/20 0.46
P2RY1 P47900 1/20 0.45
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MLYCD O95822 1/20 0.41
PTPN2 P17706 2/20 0.41
PTPN1 P18031 2/20 0.41
PTPN5 P54829 2/20 0.41
HSPD1 P10809 1/20 0.41
HSPE1 P61604 1/20 0.41
ACLY P53396 1/20 0.41
PTGS2 P35354 1/20 0.41
OXTR P30559 2/20 0.40
AVPR1A P37288 2/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL8479988 0.88 EDNRA (0.55) EDNRBEDNRAPTGS2
SCHEMBL8481520 0.87 EDNRA (0.50) HSD11B1EDNRBEDNRA
SCHEMBL8476607 0.86 EDNRA (0.53) HSD11B1EDNRBEDNRA
SCHEMBL8478606 0.85 EDNRA (0.59) HSD11B1EDNRBEDNRAP2RY1
SCHEMBL8473239 0.79 EDNRA (0.52) EDNRBEDNRAPTGS2
SCHEMBL9065130 0.76 EDNRA (0.69) EDNRBEDNRA
SCHEMBL7850015 0.76 EDNRA (0.69) EDNRBEDNRA
SCHEMBL8523604 0.75 EDNRA (0.51) EDNRBEDNRA
SCHEMBL8477061 0.75 EDNRA (0.50) HSD11B1EDNRBEDNRA
SCHEMBL30844541 0.74 EDNRA (0.68) EDNRBEDNRA

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-5859257-A ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed