SCHEMBL5453754

SCHEMBL5453754

COCCCN(Cc1cc2cccc(C)c2[nH]c1=O)S(=O)(=O)c1cccs1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.57
ALDH1A1 P00352 9/20 0.56
LMNA P02545 4/20 0.56
KMT2A Q03164 4/20 0.54
HSD17B10 Q99714 4/20 0.53
MAPT P10636 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.49
MEN1 O00255 2/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
HPGD P15428 1/20 0.46
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL5457765 0.83 KDM4E (0.62) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4074624 0.83 KDM4E (0.60) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4072282 0.79 KDM4E (0.54) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4074136 0.79 KDM4E (0.54) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4071048 0.78 USP2 (0.53) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4077833 0.78 KDM4E (0.50) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4081674 0.76 KDM4E (0.51) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4074530 0.74 KDM4E (0.56) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4074094 0.74 KDM4E (0.61) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL4071631 0.74 KDM4E (0.70) KDM4EALDH1A1LMNAKMT2AHSD17B10

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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US claimed
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof ABCG2, ATP5ME, ATP5MG KDM4E 2403/4885ALDH1A1 1055/4885LMNA 2310/4885

“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.