SCHEMBL7053665

SCHEMBL7053665

O=S(=O)(O)C=Cc1ccc([Na])cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.38
CA9 Q16790 3/20 0.38
LMNA P02545 4/20 0.34
PPARG P37231 3/20 0.33
PTPN1 P18031 3/20 0.33
NFE2L2 Q16236 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
CISD1 Q9NZ45 1/20 0.33
HTT P42858 2/20 0.32
KMT2A Q03164 3/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA3 P07451 2/20 0.31
CA4 P22748 2/20 0.31
CA6 P23280 2/20 0.31
CA5A P35218 2/20 0.31
CA7 P43166 2/20 0.31
CA13 Q8N1Q1 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA5B Q9Y2D0 2/20 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
SCHEMBL28760348 0.82 CA12 (0.40) CA12CA9LMNAPPARGPTPN1
SCHEMBL2298611 0.80 APP (0.52) CA12CA9LMNAPPARGNFE2L2
SCHEMBL2298614 0.80 APP (0.52) CA12CA9LMNAPPARGNFE2L2
SCHEMBL4617952 0.78 CYP1A2 (0.52) PPARGNFE2L2CA1CA2CYP1A2
SCHEMBL2453590 0.78 CYP19A1 (0.50) CA12CA9LMNAPTPN1TDP1
SCHEMBL14297485 0.78 LMNA (0.53) LMNAPPARGNFE2L2KMT2ACA1
SCHEMBL4617948 0.78 CYP1A2 (0.52) PPARGNFE2L2CA1CA2CYP1A2
SCHEMBL29496 0.78 TDP1 (0.57) CA12CA9LMNAPPARGPTPN1
SCHEMBL2173890 0.78 LMNA (0.53) LMNAPPARGNFE2L2KMT2ACA1
SCHEMBL28850004 0.78 HSD11B1 (0.52) NFE2L2KMT2ACA1CA2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1161497-B1 POLYAMIDE/EMULSION POLYMER BLENDS EASTMAN CHEM CO (US) 2003-05-07 EP disclosed
US-20020107319-A1 Polyamide/emulsion polymer blends EASTMAN CHEMICAL COMPANY 2002-08-08 US disclosed
US-6403698-B1 Polyamide/emulsion polymer blends EASTMAN CHEMICAL COMPANY 2002-06-11 US disclosed
EP-1161497-A1 POLYAMIDE/EMULSION POLYMER BLENDS EASTMAN CHEMICAL COMPANY (US) 2001-12-12 EP disclosed
WO-2000052079-A1 LATEX MODIFIED NYLON 6 COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2000-09-08 WO disclosed
WO-2000052097-A1 POLYAMIDE/EMULSION POLYMER BLENDS EASTMAN CHEMICAL COMPANY (US) 2000-09-08 WO disclosed