SCHEMBL7542017

SCHEMBL7542017

O=Cc1ccc(S(=O)(=O)c2ccc(C=O)c3ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.41
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2A6 P11509 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
KCNH2 Q12809 1/20 0.35
UBE2N P61088 1/20 0.35
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
HKDC1 Q2TB90 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
SCHEMBL7184588 0.86 GAA (0.41) HTR6HKDC1
SCHEMBL7198914 0.83 LDHA (0.53) HTR6CYP2D6HKDC1
SCHEMBL7195706 0.82 MEN1 (0.43) HTR6KDM4EALDH1A1TSHR
SCHEMBL7195905 0.79 HTR6 (0.40) HTR6ALDH1A1CYP2D6CYP2A6
SCHEMBL7203750 0.79 HTR6 (0.66) HTR6CYP2D6
SCHEMBL3953419 0.75 HTR6 (0.37) HTR6KDM4EALDH1A1CYP2D6CYP2A6
SCHEMBL7197731 0.74 L3MBTL1 (0.49) KDM4E
SCHEMBL7540797 0.74 ALDH1A1 (0.40) KDM4EALDH1A1CYP2A6UBE2NTSHR
SCHEMBL7184712 0.74 TTR (0.47) KDM4EALDH1A1CYP2A6HKDC1
SCHEMBL2653843 0.74 LDHA (0.58) KDM4ECYP2A6

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 HTR6 2178/4885KDM4E 3406/4885ALDH1A1 1488/4885

“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.