SCHEMBL4385959

SCHEMBL4385959

Cc1ccc(S(=O)(=O)OC[C@H]2COC(C)(C)N2C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.39
ALDH1A1 P00352 4/20 0.38
CYP2D6 P10635 3/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
MAPT P10636 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.36
MMP2 P08253 3/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
SIRT5 Q9NXA8 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL8577320 1.00 STAT3 (0.39) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL8577324 1.00 STAT3 (0.39) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL25320445 0.88 PSMD10 (0.37) STAT3ALDH1A1CYP2D6MAPTKMT2A
SCHEMBL4387114 0.87 PRMT5 (0.42) ALDH1A1KMT2AMMP2POLB
SCHEMBL4346843 0.85 SPHK1 (0.40) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL4346836 0.85 SPHK1 (0.40) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL2669188 0.85 SPHK1 (0.40) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL2156927 0.84 ELANE (0.44) MAPT
SCHEMBL4755858 0.81 STAT3 (0.32) STAT3ALDH1A1CYP2D6CYP3A4TSHR
SCHEMBL4974280 0.81 STAT3 (0.32) STAT3ALDH1A1CYP2D6CYP3A4TSHR

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-110520413-B Macrocyclic broad spectrum antibiotics 阿奇克斯制药公司 2023-02-17 CN disclosed
US-20090105227-A1 Thienopyrroles As Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-04-23 US disclosed
EP-1881989-A1 THIENOPYRROLES AS ANTIVIRAL AGENTS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2008-01-30 EP disclosed
WO-2006119975-A1 THIENOPYRROLES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2006-11-16 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-20090105227-A1 Thienopyrroles As Antiviral Agents ZC3HAV1, HAVCR2, ZC3HAV1L STAT3 372/4885ALDH1A1 433/4885CYP2D6 71/4885

“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.