SCHEMBL17323673

SCHEMBL17323673

CC(C)(C)OC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(I)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 2/20 0.62
▸ ALDH1A1 P00352 4/20 0.48
▸ MMP1 P03956 3/20 0.47
▸ MMP9 P14780 3/20 0.47
▸ MMP13 P45452 2/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ HTT P42858 1/20 0.46
▸ HCRTR1 O43613 2/20 0.45
▸ HCRTR2 O43614 2/20 0.45
▸ MMP3 P08254 2/20 0.45
▸ MMP7 P09237 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ MMP2 P08253 1/20 0.44
▸ JAK2 O60674 1/20 0.44

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
SCHEMBL16014995 0.88 CASP3 (0.62) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL16014994 0.88 CASP3 (0.62) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL16129184 0.88 CASP3 (0.62) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL7086061 0.86 CASP3 (0.61) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL7086065 0.86 CASP3 (0.61) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL31689573 0.85 CASP3 (0.62) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL8248205 0.84 CASP3 (0.59) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL5717004 0.82 CASP3 (0.59) CASP3ALDH1A1MMP1MMP13KMT2A
SCHEMBL6624711 0.81 CASP3 (0.63) CASP3ALDH1A1MMP1MMP9MMP13
SCHEMBL17394480 0.80 CASP3 (0.56) CASP3ALDH1A1MMP1MMP9MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 — — US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 — — US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 — — US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 — — 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-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO CASP3 3374/4885ALDH1A1 289/4885MMP1 469/4885

“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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