SCHEMBL27554685

SCHEMBL27554685

COC(c1cc(OB=O)cc(C(OC)(C(F)(F)F)C(F)(F)F)c1)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
RORC P51449 2/20 0.31
NR1I2 O75469 1/20 0.30

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
SCHEMBL27569350 0.97 SOD1 (0.33) NR1H2NR1H3
SCHEMBL14453638 0.78 IDO1 (0.39) NR1H2NR1H3RORCNR1I2
SCHEMBL27554604 0.77 SOD1 (0.34)
SCHEMBL6403294 0.74 NR1H2 (0.32) NR1H2NR1H3
SCHEMBL6675245 0.74 IDO1 (0.31) NR1H2NR1H3
SCHEMBL2064675 0.73 NR1H2 (0.33) NR1H2NR1H3RORCNR1I2
SCHEMBL6401770 0.71 NR1H2 (0.31) NR1H2NR1H3
SCHEMBL4359834 0.71 NR1H2 (0.31) NR1H2NR1H3
SCHEMBL5808191 0.71 NOTUM (0.33)
SCHEMBL10876573 0.71 NR1H2 (0.34) NR1H2NR1H3RORCNR1I2

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
CN-1290275-A Catalyst and process for polymerization of cycloolefin GOODRICH CO B F (US) 2001-04-04 CN claimed