SCHEMBL6785681

SCHEMBL6785681

CCOC(=O)C1(C(c2ccc(Oc3ccc(C)c(C)c3)cc2)=S(=O)=O)CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.37
GFER P55789 1/20 0.37
KMT2A Q03164 1/20 0.37
SMYD3 Q9H7B4 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
PLG P00747 1/20 0.35
PRSS1 P07477 1/20 0.35
CHEK2 O96017 1/20 0.35
FFAR1 O14842 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 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
SCHEMBL6785500 0.88 OPRM1 (0.50) OPRM1SLC6A2SLC6A4SLC6A3HPGD
SCHEMBL6785678 0.73 MMP2 (0.46) OPRM1SMYD3SMN1; SMN2
SCHEMBL6785767 0.72 KCNA3 (0.49) OPRM1L3MBTL1KMT2A
SCHEMBL7749955 0.70 MMP1 (0.46) OPRM1L3MBTL1LMNAKMT2AMAPT
SCHEMBL6437986 0.70 CA12 (0.54) L3MBTL1LMNAGFERKMT2ATDP1
SCHEMBL6796783 0.69 MMP1 (0.43)
SCHEMBL6785881 0.68 MMP13 (0.49) L3MBTL1LMNAGFERKMT2AHPGD
SCHEMBL2814112 0.68 OPRM1 (0.54) OPRM1LMNAKMT2ASMYD3SLC6A2
SCHEMBL10825801 0.65 KMT2A (0.60) L3MBTL1LMNAGFERKMT2ACHEK2
SCHEMBL1488529 0.64 OPRM1 (0.54) OPRM1KMT2ASMYD3SLC6A2SLC6A4

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-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds G.D. SEARLE & CO. 2004-05-20 US disclosed
US-6638952-B1 Matrix metalloprotease inhibitors PHARMACIA CORPORATION 2003-10-28 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-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds MMP1, MMP2, MMP10 OPRM1 4208/4885L3MBTL1 2579/4885LMNA 1209/4885

“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.