SCHEMBL21936738

SCHEMBL21936738

CSC=Nc1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 19/20 0.49
▸ PGR P06401 1/20 0.43

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
SCHEMBL21936494 0.80 AR (0.47) ARPGR
SCHEMBL12960442 0.78 AR (0.45) ARPGR
SCHEMBL18856260 0.74 AR (0.51) ARPGR
SCHEMBL4404032 0.74 AR (0.51) ARPGR
SCHEMBL4402110 0.74 AR (0.51) ARPGR
SCHEMBL16130164 0.73 AR (0.50) ARPGR
SCHEMBL1190703 0.72 AR (0.49) ARPGR
SCHEMBL189787 0.72 AR (0.49) ARPGR
SCHEMBL10297754 0.71 AR (0.71) ARPGR
SCHEMBL22834021 0.71 AR (0.47) ARPGR

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
EP-2963026-B1 SUBSTITUTED (R)-3-(4-METHYLCARBAMOYL-3-FLUOROPHENYLAMINO)TETRAHYDROFURAN-3-ENECARBOXYLIC ACID (VARIANTS) AND ESTER THEREOF, METHOD FOR PRODUCING AND USING SAME R PHARM INT LLC (RU) 2020-04-29 — — EP disclosed
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