SCHEMBL3090320

SCHEMBL3090320

COc1ccc(-c2ccc(S(=O)(=O)NCc3cnn[nH]3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
POLB P06746 2/20 0.50
MEP1B Q16820 1/20 0.50
CYP19A1 P11511 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PKM P14618 1/20 0.49
LMNA P02545 3/20 0.47
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TP53 P04637 2/20 0.47
KMT2A Q03164 1/20 0.46
TSHR P16473 2/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL3093197 0.86 HTT (0.52) ALDH1A1CYP19A1PKMLMNAMAPT
SCHEMBL3091468 0.84 MMP1 (0.49) ALDH1A1MEP1BPKMLMNAMAPT
SCHEMBL3082870 0.83 MEP1B (0.47) ALDH1A1MEP1BCYP19A1TDP1PKM
SCHEMBL3088605 0.83 CYP3A4 (0.48) ALDH1A1POLBMEP1BCYP19A1TDP1
SCHEMBL3079705 0.81 CYP19A1 (0.51) ALDH1A1POLBCYP19A1LMNASMN1; SMN2
SCHEMBL3083887 0.74 MMP2 (0.51) LMNA
SCHEMBL3085273 0.73 ALDH1A1 (0.55) ALDH1A1POLBMEP1BCYP19A1TDP1
SCHEMBL3087754 0.72 MMP2 (0.52) LMNA
SCHEMBL3087707 0.70 MMP2 (0.47) ALDH1A1POLB
SCHEMBL3091205 0.70 ALDH1A1 (0.59) ALDH1A1POLBMEP1BCYP19A1TDP1

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-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US claimed
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US disclosed
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US disclosed
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 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-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS MMP3, MMP11, MMP13 ALDH1A1 1417/4885POLB 1633/4885MEP1B 759/4885

“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.