SCHEMBL8962319

SCHEMBL8962319

O=C(O)c1ccc(S(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
APEX1 P27695 2/20 0.55
POLB P06746 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
SLC16A1 P53985 1/20 0.51
KMT2A Q03164 2/20 0.50
ACLY P53396 1/20 0.50
TSHR P16473 3/20 0.48
KDM4E B2RXH2 1/20 0.48
FLT1 P17948 1/20 0.47
FLT4 P35916 1/20 0.47
KDR P35968 1/20 0.47
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.43
CASP1 P29466 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL65212 0.87 APEX1 (0.67) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL29394064 0.87 APEX1 (0.67) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL1397921 0.87 APEX1 (0.67) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL29364883 0.87 APEX1 (0.67) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL11611376 0.87 LMNA (0.53) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL2807663 0.85 TSHR (0.59) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL268999 0.85 APEX1 (0.65) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL8999902 0.85 APEX1 (0.70) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL7820979 0.84 POLB (0.60) LMNAAPEX1POLBL3MBTL1CTDSP1
SCHEMBL2679084 0.81 MAPT (0.54) LMNAAPEX1KMT2AFLT1FLT4

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
US-5530130-A DYEING PLASTICS BAYER AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
EP-0639624-A1 Phthaloperinone dyestuffs BAYER AG (DE) 1995-02-22 EP disclosed