SCHEMBL29905579

SCHEMBL29905579

FCC(F)(F)OC=Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.38
NFE2L2 Q16236 4/20 0.38
IDO1 P14902 2/20 0.37
RELA Q04206 1/20 0.35
FBP1 P09467 1/20 0.34
TRPA1 O75762 1/20 0.34
ALDH1A1 P00352 2/20 0.34
S1PR4 O95977 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
S1PR1 P21453 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TSHR P16473 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
CYP19A1 P11511 1/20 0.33
MAOA P21397 1/20 0.33
PAM P19021 1/20 0.33

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
SCHEMBL2723539 0.79 MAOB (0.44) MAOBNFE2L2IDO1TRPA1ALDH1A1
SCHEMBL2723536 0.79 MAOB (0.44) MAOBNFE2L2IDO1TRPA1ALDH1A1
SCHEMBL187273 0.71 MAOB (0.44) MAOBNFE2L2RELATRPA1ALDH1A1
SCHEMBL7770617 0.71 MAOB (0.44) MAOBNFE2L2RELATRPA1ALDH1A1
SCHEMBL6726710 0.71 MAOB (0.44) MAOBNFE2L2IDO1RELATRPA1
SCHEMBL8092474 0.70 MAOB (0.35) MAOBNFE2L2IDO1TRPA1ALDH1A1
SCHEMBL8996775 0.69 MAOB (0.42) MAOBNFE2L2IDO1RELATRPA1
SCHEMBL3783785 0.69 RELA (0.43) MAOBIDO1RELATRPA1ALDH1A1
SCHEMBL15709852 0.68 MAOB (0.50) MAOBNFE2L2IDO1TRPA1ALDH1A1
SCHEMBL9800772 0.68 NFE2L2 (0.54) MAOBNFE2L2RELAFBP1TRPA1

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-11442013-B2 Sensor membrane, sensor cap and/or optical sensor and method for manufacturing a sensor membrane ENDRESS+HAUSER CONDUCTA GMBH+CO. KG (DE) 2022-09-13 US disclosed