SCHEMBL3087742

SCHEMBL3087742

COc1ccc(-c2ccc(S(=O)(=O)NCC#Cc3ccccc3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.65
MMP13 P45452 8/20 0.65
MMP3 P08254 7/20 0.65
MMP1 P03956 3/20 0.65
MMP9 P14780 2/20 0.65
MMP8 P22894 1/20 0.65
ALDH1A1 P00352 5/20 0.57
POLB P06746 1/20 0.54
MEP1B Q16820 1/20 0.52
PKM P14618 1/20 0.51
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP19A1 P11511 1/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL28641212 0.84 ALDH1A1 (0.62) MMP2MMP13MMP3ALDH1A1PKM
SCHEMBL26234061 0.83 ALDH1A1 (0.50) MMP2MMP13MMP3ALDH1A1PKM
SCHEMBL7898412 0.80 MMP2 (0.68) MMP2MMP13MMP3MMP1MMP9
SCHEMBL30667707 0.80 CA12 (0.58) MMP2MMP13MMP3ALDH1A1POLB
SCHEMBL7899813 0.80 MMP2 (0.56) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7516814 0.79 MMP13 (1.00) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7502269 0.78 MMP13 (0.86) MMP2MMP13MMP3MMP1MMP9
SCHEMBL3091205 0.77 ALDH1A1 (0.59) MMP2MMP13MMP1MMP9MMP8
SCHEMBL7502278 0.73 MMP13 (0.55) MMP2MMP13MMP3MMP1MMP9
SCHEMBL8446269 0.73 MEP1B (0.58) MMP2MMP13MMP3MMP1MMP9

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-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US disclosed
WO-2008024784-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2008-02-28 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-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS MMP3, MMP11, MMP13 MMP2 14/4885MMP13 3/4885MMP3 1/4885

“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.