SCHEMBL6834783

SCHEMBL6834783

O=C(O)c1ccc2c(c1)C(=O)C(Cc1ccc(Cl)c(Cl)c1)[S+]([O-])N2

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
EPHX2 P34913 1/20 0.37
HAO1 Q9UJM8 1/20 0.36
S1PR5 Q9H228 1/20 0.35
SRD5A2 P31213 1/20 0.35
KDM4E B2RXH2 1/20 0.33
PYGL P06737 1/20 0.33
PYGM P11217 1/20 0.33

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
SCHEMBL6835278 0.91 KDM5A (0.35) TSHR
SCHEMBL6831785 0.91 KDM4E (0.36) KDM4E
SCHEMBL6831723 0.90 ALDH1A1 (0.38) TSHR
SCHEMBL6835347 0.86 RXRA (0.40)
SCHEMBL6680629 0.85 KMT2A (0.40)
SCHEMBL6835570 0.85 GRK6 (0.34) TSHR
SCHEMBL6835283 0.81 LMNA (0.47) EPHX2
SCHEMBL6831758 0.77 TSHR (0.39) TSHREPHX2HAO1S1PR5KDM4E
SCHEMBL6685148 0.76 TSHR (0.43) TSHREPHX2PYGLPYGM
SCHEMBL6834773 0.76 MAPT (0.42) EPHX2

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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors HICKS JAMES LESTER (US) 2004-03-04 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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors MMP13, MMP26, MMP9 TSHR 3050/4885EPHX2 1812/4885HAO1 440/4885

“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.