SCHEMBL11683029

SCHEMBL11683029

O=S(=O)(c1ccc(Cl)cc1CO)c1ccc(Cl)cc1CO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
PSEN1 P49768 12/20 0.42
PSEN2 P49810 12/20 0.42
APH1B Q8WW43 12/20 0.42
NCSTN Q92542 12/20 0.42
APH1A Q96BI3 12/20 0.42
PSENEN Q9NZ42 12/20 0.42
MEN1 O00255 1/20 0.41
SLC22A1 O15245 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CYP3A4 P08684 1/20 0.41
HSPD1 P10809 1/20 0.41
HSPA5 P11021 1/20 0.41
IDO1 P14902 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41

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
SCHEMBL1808822 0.86 MAPT (0.44) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL1039443 0.85 ADRA1D (0.48) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL1809065 0.85 PTGS2 (0.49) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL23665727 0.82 PSEN1 (0.41) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL11545414 0.82 DDR1 (0.44) MAPTMEN1SLC22A1USP2LMNA
SCHEMBL2914223 0.82 TRPV4 (0.39) MAPTMEN1SLC22A1USP2LMNA
SCHEMBL14395643 0.81 DDR1 (0.38) MAPTMEN1SLC22A1USP2LMNA
SCHEMBL5957559 0.78 CNR2 (0.40) MAPTMEN1SLC22A1USP2LMNA
SCHEMBL23665847 0.78 PSEN1 (0.42) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL11680272 0.76 MEP1B (0.38) PSEN1PSEN2APH1BNCSTNAPH1A

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
US-4057418-A Sulfonylmethylamino-substituted benzoic acids and herbicidal method therewith BAYER AKTIENGESELLSCHAFT (DT) 1977-11-08 US disclosed