SCHEMBL1286016

SCHEMBL1286016

O=C(O)c1cccc(C(=O)S(=O)(=O)Oc2ccc3ccccc3c2)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ PPARG P37231 1/20 0.43
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ TDP1 Q9NUW8 3/20 0.40
▸ PTPN7 P35236 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ CDC25B P30305 2/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39

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
SCHEMBL1285933 0.81 MEN1 (0.49) CA1CA2CA9MEN1KMT2A
SCHEMBL7010102 0.74 MEN1 (0.53) MEN1KMT2AL3MBTL1CASP3SENP8
SCHEMBL6883731 0.71 ACMSD (0.55) MEN1KMT2APOLBCDC25BACMSD
SCHEMBL11700529 0.70 NR4A1 (0.45) CA1CA2CA9MEN1KMT2A
SCHEMBL11703815 0.69 L3MBTL1 (0.58) CA1CA2CA9MEN1KMT2A
SCHEMBL7008991 0.69 POLB (0.43) CA1CA2CA9POLBCDC25B
Phthalic Acid SCHEMBL28157526 0.68 ALDH1A1 (0.74) CA1CA2CA9KMT2AMAPT
SCHEMBL711798 0.68 ALDH1A1 (0.63) CA1CA2CA9KMT2AMAPT
SCHEMBL23288 0.68 ALDH1A1 (0.63) CA1CA2CA9KMT2AMAPT
SCHEMBL31448244 0.68 PTPN1 (0.54) CA1CA2CA9MEN1KMT2A

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-20120088087-A1 AMPHIPHILIC POLYCONDENSATION PRODUCTS AND USE IN COMBINATION WITH POLYESTER OR POLYESTER CONTAINING SURFACES POLYPREC GMBH (DE) 2012-04-12 — — US disclosed
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