SCHEMBL347082

SCHEMBL347082

COc1ccc2c(S(=O)(=O)O)occ2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.43
MTNR1A P48039 2/20 0.41
ALDH1A1 P00352 3/20 0.40
CA2 P00918 2/20 0.40
KDM4E B2RXH2 4/20 0.40
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA3 P07451 1/20 0.38
AKR1B1 P15121 1/20 0.38
HPGD P15428 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA14 Q9ULX7 1/20 0.38
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
XDH P47989 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
SCHEMBL3616609 0.73 KDM4E (0.54) ALDH1A1CA2KDM4ECA12CA1
SCHEMBL11684807 0.73 ALDH1A1 (0.51) MTNR1AALDH1A1KDM4EHPGDMAOA
SCHEMBL10373029 0.73 CYP2A6 (0.45) ALDH1A1KDM4EHPGDHSD17B10MAOA
SCHEMBL3472814 0.70 CYP1A2 (0.47) SLC2A1MTNR1ACYP1A2CYP2A6LMNA
SCHEMBL1726389 0.69 MEN1 (0.61) SLC2A1KDM4EHSD17B10CYP1A2CYP2A6
SCHEMBL8315786 0.69 ALDH1A1 (0.45) ALDH1A1CA2KDM4EHPGDCYP1A2
SCHEMBL4016088 0.68 MEN1 (0.59) SLC2A1KDM4EHSD17B10CYP1A2CYP2A6
SCHEMBL3772672 0.68 MEN1 (0.59) SLC2A1KDM4EHSD17B10CYP1A2CYP2A6
SCHEMBL1511820 0.68 KDM4E (0.51) ALDH1A1CA2KDM4ECA12CA3
SCHEMBL2326546 0.67 MEN1 (0.58) SLC2A1KDM4EHSD17B10CYP1A2CYP2A6

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
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP 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 (2 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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR SLC2A1 4356/4885MTNR1A 3817/4885ALDH1A1 302/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR SLC2A1 4296/4885MTNR1A 3864/4885ALDH1A1 292/4885

“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.