SCHEMBL8735700

SCHEMBL8735700

CC(C)c1cccc(Cl)c1S(=O)(=O)OC[PH](=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
CCR6 P51684 1/20 0.32
ELANE P08246 1/20 0.32
FAAH O00519 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
GABRB1 P18505 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
GABRA5 P31644 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
SCHEMBL8731854 0.85 KMT2A (0.34) SMN1; SMN2LMNA
SCHEMBL8854562 0.84 SMN1; SMN2 (0.31) SMN1; SMN2GABRA1GABRG2GABRB3CCR6
SCHEMBL8734771 0.82 SLC40A1 (0.35) ELANELMNATSHR
SCHEMBL27548401 0.81 CYP1A2 (0.31) SMN1; SMN2LMNACYP1A2CYP3A4
SCHEMBL8731811 0.78 SMN1; SMN2 (0.37) SMN1; SMN2GABRA1GABRG2GABRB3CCR6
SCHEMBL27388412 0.78 CYP1A2 (0.33) CXCL8SMN1; SMN2GABRA1GABRG2GABRB3
SCHEMBL8763841 0.77 NR1H4 (0.33) SMN1; SMN2GABRA1GABRG2GABRB3NR1H4
SCHEMBL27288328 0.77 PNMT (0.42) CA1
SCHEMBL8734839 0.76 LMNA (0.30) LMNA
SCHEMBL8854468 0.76 CYP1A2 (0.33) CXCL8GABRA1GABRG2GABRB3CCR6

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-0699390-B1 Compositions containing phosphosulfonate herbicides and dichloroacetamide safeners, and method of use ROHM & HAAS (US) 1998-10-07 EP claimed
CN-1037568-C Phosphosulfonate herbicides ROHM & HAAS (US) 1998-03-04 CN disclosed