SCHEMBL8764415

SCHEMBL8764415

Cc1cccc(C(F)(F)F)c1S(=O)(=O)OCP(C)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
SCN8A Q9UQD0 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALOX12 P18054 1/20 0.31
ACP3 P15309 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
SCHEMBL8729932 0.91 ACP3 (0.34) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8762790 0.87 SCN8A (0.32) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8763877 0.85 MEN1 (0.34) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8764757 0.85 PTPN5 (0.36) MEN1KMT2ATSHRMAPTHPGD
SCHEMBL8734549 0.83 NR1H2 (0.31) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8732667 0.82 KDM4E (0.33) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8409435 0.81 MEN1 (0.32) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8763787 0.81 MEN1 (0.30) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8412043 0.80 MEN1 (0.38) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8764044 0.80 SMN1; SMN2 (0.36) KMT2ATSHRALDH1A1ATM

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