SCHEMBL2923150

SCHEMBL2923150

CC(C)CS(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.52
▸ ENPP2 Q13822 1/20 0.50
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 1/20 0.46
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ ESR1 P03372 2/20 0.43
▸ MMP13 P45452 2/20 0.42
▸ MMP1 P03956 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ADAMTS4 O75173 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39

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
SCHEMBL2779200 0.81 ALDH1A1 (0.57) CA2KMT2ACA12CA1CA9
SCHEMBL20323484 0.80 CA1 (0.52) CA2KMT2ACA12CA1CA9
SCHEMBL4873168 0.79 GAA (0.61) CA2KMT2ALMNACA12CA1
SCHEMBL4010614 0.79 CA1 (0.49) CA2KMT2ACA1MMP13MMP1
SCHEMBL3067678 0.79 MMP13 (0.42) KMT2AMMP13MMP1GAAMEN1
SCHEMBL330253 0.79 PLCG1 (0.59) CA2KMT2ACA12CA1CA9
SCHEMBL11951567 0.79 GAA (0.46) CA2LMNACA12CA1CA9
SCHEMBL2592148 0.79 TAS2R14 (0.58) CA2KMT2ACA12CA1CA9
SCHEMBL17394192 0.79 ENPP2 (0.55) CA2ENPP2KMT2ACA1MMP13
SCHEMBL778303 0.78 PSIP1 (0.60) KMT2AGAAMEN1ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222160-B1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD (AU) 2015-03-18 — — EP disclosed
US-8426587-B2 Haloallylamine inhibitors of SSAO/VAP-1 and uses therefor PHARMAXIS LTD. (AU) 2013-04-23 — — US disclosed
US-20100298330-A1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD. (AU) 2010-11-25 — — US disclosed
EP-2222160-A2 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR Pharmaxis Ltd. (AU) 2010-09-01 — — EP disclosed
WO-2009066152-A2 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD. (US) 2009-05-28 — — WO 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-20100298330-A1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR VAPA, SLC6A11, VAPB CA2 3200/4885ENPP2 1553/4885KMT2A 3980/4885

“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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