SCHEMBL22500549

SCHEMBL22500549

Cc1ccc(S(=O)(=O)NC(CC(C)C)C(=O)N2CCOCC2)cc1

nearest known ligand 0.98

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.98
MEN1 O00255 2/20 0.98
AIMP2 Q13155 1/20 0.98
ALDH1A1 P00352 4/20 0.61
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MAPK1 P28482 1/20 0.52
GAA P10253 1/20 0.51
F2 P00734 1/20 0.51
POLB P06746 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.50

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
SCHEMBL22500547 1.00 KMT2A (0.98) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22501084 1.00 KMT2A (0.98) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL17086576 0.99 KMT2A (1.00) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22500262 0.99 KMT2A (1.00) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22500261 0.99 KMT2A (1.00) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22501285 0.90 MEN1 (0.83) KMT2AMEN1AIMP2ALDH1A1GAA
SCHEMBL22501283 0.90 MEN1 (0.83) KMT2AMEN1AIMP2ALDH1A1GAA
SCHEMBL22500340 0.89 MEN1 (0.79) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22500318 0.88 MEN1 (0.81) KMT2AMEN1AIMP2ALDH1A1TSHR
SCHEMBL22501273 0.88 KMT2A (0.77) KMT2AMEN1AIMP2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113874361-B Compound with anticancer activity and preparation method thereof 医药生命融合研究团 2024-07-12 CN claimed
US-20220204497-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME DONGGUK UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2022-06-30 US claimed
EP-3939968-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME Medicinal Bioconvergence Research Center (KR) 2022-01-19 EP claimed
CN-113874361-A Novel compound with anticancer activity and preparation method thereof 医药生命融合研究团 2021-12-31 CN claimed
CN-113874361-B Compound with anticancer activity and preparation method thereof 医药生命融合研究团 2024-07-12 CN disclosed
US-20220204497-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME DONGGUK UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2022-06-30 US disclosed
EP-3939968-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME Medicinal Bioconvergence Research Center (KR) 2022-01-19 EP disclosed
CN-113874361-A Novel compound with anticancer activity and preparation method thereof 医药生命融合研究团 2021-12-31 CN disclosed
WO-2020204548-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME 재단법인 의약바이오컨버젼스연구단 2020-10-08 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-20220204497-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME TPX2, AIMP2, CDYL2 KMT2A 1721/4885MEN1 479/4885AIMP2 2/4885

“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.