SCHEMBL4478031

SCHEMBL4478031

CCC(C(=O)O)c1ccccc1S(=O)(=O)C1CCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MMP2 P08253 2/20 0.37
▸ MMP9 P14780 2/20 0.37
▸ MMP12 P39900 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ MMP1 P03956 1/20 0.35
▸ MMP8 P22894 1/20 0.35
▸ MMP13 P45452 1/20 0.35
▸ MMP14 P50281 1/20 0.35
▸ MMP16 P51512 1/20 0.35
▸ RBP4 P02753 1/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA5A P35218 1/20 0.34
▸ CA7 P43166 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
SCHEMBL2651546 0.80 GCK (0.43) —
SCHEMBL2651852 0.80 GCK (0.43) —
SCHEMBL28149352 0.78 MMP2 (0.41) MMP2MMP9MMP12ALDH1A1MMP1
SCHEMBL15302641 0.78 MMP2 (0.41) MMP2MMP9MMP12ALDH1A1MMP1
SCHEMBL4478028 0.75 GCK (0.41) MEN1KMT2AALDH1A1MMP1MMP8
SCHEMBL2662501 0.74 GCK (0.40) —
SCHEMBL9962274 0.72 COMT (0.38) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL4599595 0.70 TSHR (0.51) MMP2MMP9ALDH1A1MMP1MMP8
SCHEMBL2651371 0.70 MMP2 (0.50) MMP2MMP9MMP12MMP1MMP8
SCHEMBL2514353 0.69 GCK (0.43) ALDH1A1

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-7582632-B2 Tri(cyclo) substituted amide compounds PROSIDION LIMITED (GB) 2009-09-01 — — US disclosed
US-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS OSI PHARMACEUTICALS, INC. 2007-12-06 — — 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-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS IAPP, GPR119, SLC5A1 MEN1 2044/4885KMT2A 3964/4885MMP2 2268/4885

“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.

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