SCHEMBL8764757

SCHEMBL8764757

COc1cccc(C(F)(F)F)c1S(=O)(=O)OCP(C)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.36
ATM Q13315 1/20 0.36
MAOB P27338 1/20 0.35
NFE2L2 Q16236 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ADORA2A P29274 1/20 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
SCHEMBL8729840 0.91 PTPN5 (0.36) PTPN5ATMMAOBNFE2L2SMN1; SMN2
SCHEMBL8762778 0.88 ATM (0.37) PTPN5ATMMAOBNFE2L2SMN1; SMN2
SCHEMBL8764415 0.85 MEN1 (0.33) ATMKDM4EKMT2AMEN1TSHR
SCHEMBL8729845 0.83 SMN1; SMN2 (0.33) ATMMAOBNFE2L2SMN1; SMN2LMNA
SCHEMBL8729873 0.83 ATM (0.34) ATMMAOBNFE2L2SMN1; SMN2LMNA
SCHEMBL8731887 0.82 NFE2L2 (0.35) ATMMAOBNFE2L2SMN1; SMN2LMNA
SCHEMBL8764036 0.82 SMN1; SMN2 (0.32) ATMNFE2L2SMN1; SMN2MAPTHPGD
SCHEMBL8734572 0.81 NFE2L2 (0.38) PTPN5ATMMAOBNFE2L2SMN1; SMN2
SCHEMBL8764702 0.80 SMN1; SMN2 (0.32) ATMMAOBNFE2L2SMN1; SMN2LMNA
SCHEMBL8729954 0.80 CTSS (0.34) ATMMAOBNFE2L2SMN1; SMN2LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0511826-B1 Phosphosulfonate herbicides ROHM & HAAS (US) 1997-07-16 EP claimed
EP-0511826-A2 Phosphosulfonate herbicides ROHM AND HAAS COMPANY (US) 1992-11-04 EP claimed