SCHEMBL8854446

SCHEMBL8854446

CCSc1cccc(C(F)(F)F)c1S(=O)(=O)OCO[PH](=O)OCOS(=O)(=O)c1c(SCC)cccc1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.33
CCR2 P41597 1/20 0.33
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
NOS2 P35228 2/20 0.32

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
SCHEMBL8854456 0.91 AR (0.32) ARCCR2NOS3NOS1NOS2
SCHEMBL8854448 0.88 STK10 (0.33)
SCHEMBL27489845 0.84
SCHEMBL27467844 0.84 AR (0.30) AR
SCHEMBL8730132 0.83 AR (0.33) ARCCR2
SCHEMBL8854723 0.83 AR (0.35) ARCCR2
SCHEMBL8854482 0.83 AR (0.33) ARCCR2
SCHEMBL27467359 0.83
SCHEMBL27544000 0.83 GABRA1 (0.34) AR
SCHEMBL27450980 0.83 GAA (0.32)

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-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed