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
SCHEMBL2651852 0.80 GCK (0.43)
SCHEMBL2651546 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.