SCHEMBL20135306

SCHEMBL20135306

Cc1ccc(S(=O)(=O)N/N=C/C2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 6/20 0.56
STS P08842 6/20 0.53
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
GPR119 Q8TDV5 5/20 0.50
MMP1 P03956 3/20 0.46
MMP3 P08254 3/20 0.46
MMP7 P09237 3/20 0.46
MMP9 P14780 3/20 0.46
MMP8 P22894 3/20 0.46
MMP2 P08253 2/20 0.46
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL20135307 1.00 MMP13 (0.56) MMP13STSKMT2AMEN1GPR119
SCHEMBL24362392 0.89 MMP13 (0.48) MMP13STSKMT2AMEN1GPR119
SCHEMBL29768932 0.85 MMP13 (0.46) MMP13STSKMT2AMEN1GPR119
SCHEMBL29768871 0.85 MMP13 (0.45) MMP13STSKMT2AMEN1GPR119
SCHEMBL20135393 0.84 ALDH1A1 (0.44) MMP13KMT2AMEN1ALDH1A1
SCHEMBL28909554 0.84 TGFBR1 (0.47) MMP13STSGPR119MMP1
SCHEMBL28909557 0.84 TGFBR1 (0.47) MMP13STSGPR119MMP1
SCHEMBL29768875 0.83 MMP13 (0.44) MMP13STSKMT2AMEN1GPR119
SCHEMBL5330597 0.81 LMNA (0.47) MMP13STSKMT2AMEN1GPR119
SCHEMBL18314687 0.81 LMNA (0.47) MMP13STSKMT2AMEN1GPR119

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
CN-112437772-A Bcl-2 inhibitors 百济神州有限公司 2021-03-02 CN disclosed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US disclosed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 US disclosed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP 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 (2 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-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP1 MMP13 7/4885STS 1401/4885KMT2A 2568/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 MMP13 8/4885STS 1402/4885KMT2A 2539/4885

“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.