SCHEMBL2289197

SCHEMBL2289197

Cc1ccc(S(=O)(=O)Cc2ccc(C=O)c(COc3c(C)cccc3C)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
SPHK1 Q9NYA1 3/20 0.38
SCN8A Q9UQD0 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SPHK2 Q9NRA0 2/20 0.35
POLB P06746 2/20 0.35
ESR1 P03372 1/20 0.34
NR4A1 P22736 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN5 P54829 1/20 0.34
PTPN11 Q06124 1/20 0.34
ESR2 Q92731 1/20 0.34

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
SCHEMBL2288687 0.85 SCN8A (0.36) MAPTSPHK1SCN8AMAOAMAOB
SCHEMBL2290246 0.84 MAPT (0.41) MAPTSPHK1SCN8AMAOBLMNA
SCHEMBL2293180 0.81 SCN8A (0.35) MAPTSCN8AMAOAMAOBLMNA
SCHEMBL2292546 0.80 MEN1 (0.44) MAPTMAOBLMNAALDH1A1HPGD
SCHEMBL1201073 0.78 ERN1 (0.41) MAPTSCN8AMAOAMAOBLMNA
SCHEMBL2292560 0.76 LMNA (0.41) MAPTLMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL1201226 0.76 ALDH1A1 (0.36) MAPTSCN8AMAOAMAOBLMNA
SCHEMBL2289742 0.76 TSHR (0.39) MAPTSCN8AMAOAMAOBLMNA
SCHEMBL2290957 0.76 SCN8A (0.35) MAPTSCN8AMAOAMAOBLMNA
SCHEMBL2293213 0.76 SCN4A (0.35) MAPTSCN8AMAOAMAOBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2149545-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-10-05 EP disclosed
US-7994367-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-09 US disclosed
US-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 US disclosed
EP-2149545-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-03 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 (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-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, C9, TRPA1 MAPT 3284/4885SPHK1 3541/4885SCN8A 1991/4885

“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.