SCHEMBL2396866

SCHEMBL2396866

O=C(O)c1cccc(C(=O)O)c1C1=CS(=O)(=O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
HNF4A P41235 1/20 0.45
MYC P01106 1/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.43
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 2/20 0.40
RAB9A P51151 2/20 0.39
GFER P55789 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
CA7 P43166 2/20 0.38

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
SCHEMBL9565755 0.73 MAOB (0.50) ALDH1A1MAPTLMNAHSD17B10RAB9A
SCHEMBL11632005 0.71 L3MBTL1 (0.60) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL69716 0.70 ALDH1A1 (0.69) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL70265 0.70 ALDH1A1 (0.63) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL3616574 0.69 ALDH1A1 (0.74) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL31278212 0.69 ALDH1A1 (0.74) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL18061094 0.69 MAOB (0.39) ALDH1A1MAPTLMNAPTGDR2HSD17B10
Hydrochloric Acid SCHEMBL2402126 0.67 ALDH1A1 (0.71) ALDH1A1MAPTL3MBTL1LMNAHNF4A
Hydrochloric Acid SCHEMBL15366836 0.67 ALDH1A1 (0.71) ALDH1A1MAPTL3MBTL1LMNAHNF4A
SCHEMBL5089936 0.67 ALDH1A1 (0.66) ALDH1A1MAPTL3MBTL1LMNAHNF4A

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-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 ALDH1A1 1882/4885MAPT 1923/4885L3MBTL1 4274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.