SCHEMBL4401844

SCHEMBL4401844

CC(C)(C)OC(=O)NCCNC(=S)Nc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
LMNA P02545 5/20 0.54
ALDH1A1 P00352 3/20 0.54
RAB9A P51151 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ABAT P80404 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
XBP1 P17861 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GAA P10253 4/20 0.51
MAPT P10636 3/20 0.51
ALOX12 P18054 2/20 0.51
NPC1 O15118 1/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
HTT P42858 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL4392250 0.94 KMT2A (0.54) KMT2ALMNAALDH1A1RAB9AL3MBTL1
SCHEMBL4396662 0.94 KMT2A (0.54) KMT2ALMNAALDH1A1RAB9AL3MBTL1
SCHEMBL1258720 0.93 ALDH1A1 (0.53) KMT2ALMNAALDH1A1RAB9AL3MBTL1
SCHEMBL31300043 0.86 CYP1A2 (0.58) KMT2ALMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL15284035 0.85 SMN1; SMN2 (0.58) KMT2ALMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL14515852 0.85 LMNA (0.64) KMT2ALMNAALDH1A1RAB9AL3MBTL1
SCHEMBL31300041 0.85 ALDH1A1 (0.59) LMNAALDH1A1RAB9ASMN1; SMN2GAA
SCHEMBL5668241 0.84 CA1 (0.50) KMT2ALMNASMN1; SMN2NPSR1GAA
SCHEMBL2425405 0.84 ALDH1A1 (0.55) KMT2ALMNAALDH1A1RAB9AL3MBTL1
SCHEMBL1258488 0.82 ABAT (0.64) KMT2ALMNAALDH1A1RAB9AL3MBTL1

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
WO-2025024883-A1 NOVEL BROAD SPECTRUM ANTIVIRAL AND ANTIMICROBIAL PEPTIDE MIMICS NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2025-02-06 WO disclosed
EP-1300401-B1 THIAZOLE DERIVATIVES FOR USE AS ANTIINFLAMMATORIES DAINIPPON SUMITOMO PHARMA CO (JP) 2009-12-09 EP disclosed
US-7396842-B2 Five-membered cyclic compounds DIANIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-07-08 US disclosed
US-7396842-B2 Five-membered cyclic compounds DIANIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-07-08 US disclosed
EP-1669070-A2 2-imino-thiazolidine and -oxazolidine derivatives for use as antiinflammatory agents Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-06-14 EP disclosed
US-20050222226-A1 Five-membered cyclic compounds SUMITOMO PHARMACEUTICALS COMPANY, LIMITED 2005-10-06 US disclosed
US-6919361-B2 Five-membered-ring compound SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-07-19 US disclosed
US-20040072827-A1 Five-membered-ring compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2004-04-15 US disclosed
EP-1300401-A1 FIVE-MEMBERED-RING COMPOUND SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-04-09 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-20040072827-A1 Five-membered-ring compound EPX, IL5, CCR9 KMT2A 2344/4885LMNA 4315/4885ALDH1A1 3257/4885
US-20050222226-A1 Five-membered cyclic compounds EPX, CCL11, CCR9 KMT2A 2559/4885LMNA 3956/4885ALDH1A1 3404/4885

“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.