SCHEMBL8854564

SCHEMBL8854564

Cc1cccc(Cl)c1S(=O)(=O)OCO[PH](=O)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
NR3C1 P04150 1/20 0.32
KMT2A Q03164 1/20 0.32
CCR1 P32246 3/20 0.32
ESR1 P03372 2/20 0.32
ATM Q13315 1/20 0.31
AKR1C3 P42330 1/20 0.30

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
SCHEMBL8854423 0.90 KMT2A (0.33) LMNAKMT2AATM
SCHEMBL9715139 0.89 SLC40A1 (0.35) SLC40A1ALDH1A1LMNAALOX15TSHR
SCHEMBL8734771 0.83 SLC40A1 (0.35) SLC40A1ALDH1A1LMNAALOX15TSHR
SCHEMBL8854562 0.83 SMN1; SMN2 (0.31) LMNA
SCHEMBL8854550 0.81 LMNA (0.34) ALDH1A1LMNA
SCHEMBL27447928 0.81 PNMT (0.44) LMNAHTT
SCHEMBL8854489 0.81
SCHEMBL8854428 0.80 SCN8A (0.33) ALDH1A1TSHRKMT2AATM
SCHEMBL8854755 0.79 GAA (0.30)
SCHEMBL8764019 0.78 SLC40A1 (0.36) SLC40A1ALDH1A1LMNAALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed
CN-1133120-A Combination containing phosphine sulfonate ester herbicide and dichloro acetamide safety agent ROHM & HAAS (US) 1996-10-16 CN claimed
EP-0511826-A2 Phosphosulfonate herbicides ROHM AND HAAS COMPANY (US) 1992-11-04 EP claimed