SCHEMBL9804281

SCHEMBL9804281

CC(Oc1ccc(-c2ncc(Cl)cc2F)cc1O)C(=O)OCP(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SCN9A Q15858 3/20 0.33
FPR2 P25090 1/20 0.33
GABRA5 P31644 1/20 0.33
FBP1 P09467 1/20 0.32
TSHR P16473 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
MAPT P10636 2/20 0.32
CTSA P10619 2/20 0.32
S1PR2 O95136 1/20 0.32
KCNQ3 O43525 1/20 0.32
KCNQ2 O43526 1/20 0.32
PPOX P50336 1/20 0.31

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
SCHEMBL9804321 0.91 SCN9A (0.34) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL9804332 0.89 S1PR1 (0.36) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL10414342 0.86 L3MBTL1 (0.39) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL9804353 0.86 TDP1 (0.36) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL9804293 0.86 TDP1 (0.36) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL7612806 0.86 TSHR (0.36) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL7608524 0.85 P2RX3 (0.36) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL10414341 0.85 S1PR1 (0.38) S1PR1S1PR3MEN1KMT2ATDP1
SCHEMBL10564119 0.85 L3MBTL1 (0.38) S1PR1S1PR3L3MBTL1MEN1KMT2A
SCHEMBL10569790 0.85 S1PR1 (0.38) S1PR1S1PR3MEN1KMT2ATDP1

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-0200677-B1 3-FLUOROPYRIDYL-2-OXY-PHENOXY DERIVATIVES WITH A HERBICIDAL ACTIVITY CIBA-GEIGY AG (CH) 1991-04-03 EP claimed