SCHEMBL3824293

SCHEMBL3824293

O=S(=O)(O)c1ccc(C(O)c2ccccc2)c(O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.49
▸ CA2 P00918 4/20 0.49
▸ CA9 Q16790 4/20 0.49
▸ CA12 O43570 1/20 0.49
▸ CA14 Q9ULX7 1/20 0.49
▸ TSHR P16473 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ SNCA P37840 1/20 0.41
▸ TYR P14679 1/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPK1 P28482 1/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ DUSP3 P51452 1/20 0.38
▸ PTPN5 P54829 1/20 0.38
▸ CASP7 P55210 1/20 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
SCHEMBL17703180 0.77 TYR (0.65) TYRGAA
SCHEMBL11865275 0.77 TYR (0.65) TYRGAA
SCHEMBL8365957 0.74 TYR (0.49) CA1CA2CA9CA12CA14
SCHEMBL7012899 0.74 CHRM1 (0.55) SMN1; SMN2ALDH1A1HPGDTYRLMNA
SCHEMBL28220955 0.74 TYR (0.43) TSHRALDH1A1HSD17B10HPGDTYR
SCHEMBL984999 0.72 MAPT (0.50) CA1CA2CA9CA12CA14
SCHEMBL29405346 0.72 MAPT (0.50) CA1CA2CA9CA12CA14
Diphenylmethanol SCHEMBL28302196 0.71 CA12 (0.57) CA1CA2CA9CA12CA14
SCHEMBL21726592 0.71 ALDH1A1 (0.53) CA1CA2CA9CA12CA14
SCHEMBL12799419 0.70 MEN1 (0.46) TSHRSMN1; SMN2ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010294-B1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2015-12-02 — — EP claimed
US-7906684-B2 Antioxidants MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-03-15 — — US claimed
US-20090246158-A1 ANTIOXIDANTS MERCK PATENT GESELLSCHAFT (DE) 2009-10-01 — — US claimed
EP-2010294-A1 ANTIOXIDANTS Merck Patent GmbH (DE) 2009-01-07 — — EP claimed
WO-2007121845-A1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2007-11-01 — — WO claimed
EP-2010294-B1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2015-12-02 — — EP disclosed
US-7906684-B2 Antioxidants MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-03-15 — — US disclosed
US-20090246158-A1 ANTIOXIDANTS MERCK PATENT GESELLSCHAFT (DE) 2009-10-01 — — US disclosed
EP-2010294-A1 ANTIOXIDANTS Merck Patent GmbH (DE) 2009-01-07 — — EP disclosed
WO-2007121845-A1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2007-11-01 — — WO 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-20090246158-A1 ANTIOXIDANTS LPO, GPX1, GPX4 CA1 2560/4885CA2 1809/4885CA9 3221/4885

“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.

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