SCHEMBL2676334

SCHEMBL2676334

CC(C)N[C@@H](Cc1ccc(CN)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.47
ACE P12821 5/20 0.46
ACE2 Q9BYF1 5/20 0.46
CPA1 P15085 4/20 0.46
FOLH1 Q04609 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
LMNA P02545 2/20 0.43
LTA4H P09960 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.42
KLKB1 P03952 1/20 0.41
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
ALB P02768 1/20 0.41
ESR1 P03372 1/20 0.41
ALOX5 P09917 1/20 0.41
RARB P10826 1/20 0.41
CYP2C9 P11712 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL3870647 1.00 MME (0.47) MMEACEACE2CPA1FOLH1
SCHEMBL12864805 0.87 MME (0.50) MMEACEACE2CPA1FOLH1
SCHEMBL13957703 0.87 MME (0.50) MMEACEACE2CPA1FOLH1
SCHEMBL5738141 0.85 FOLH1 (0.61) MMEACEACE2CPA1FOLH1
SCHEMBL30063730 0.85 TDP1 (0.52) MMEACEACE2CPA1FOLH1
SCHEMBL12869808 0.85 FOLH1 (0.61) MMEACEACE2CPA1FOLH1
SCHEMBL2781126 0.84 MME (0.58) MMEACEACE2CPA1L3MBTL1
SCHEMBL15592756 0.84 MME (0.58) MMEACEACE2CPA1L3MBTL1
SCHEMBL123574 0.84 MME (0.58) MMEACEACE2CPA1L3MBTL1
Hydrochloric Acid SCHEMBL6774734 0.83 MME (0.47) MMEACEACE2CPA1FOLH1

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313835-A1 MICELLAR NANOPARTICLES AND USES THEREOF BIORCHESTRA CO., LTD. (KR) 2025-10-09 US disclosed
EP-4603589-A2 MICELLAR NANOPARTICLES AND USES THEREOF Biorchestra Co., Ltd. (KR) 2025-08-20 EP disclosed
WO-2025149946-A1 MICELLAR NANOPARTICLES AND USES THEREOF BIORCHESTRA CO., LTD. (KR) 2025-07-17 WO disclosed
EP-3990028-B1 MICELLAR NANOPARTICLES AND USES THEREOF BIORCHESTRA CO LTD (KR) 2025-06-04 EP disclosed
EP-4551193-A1 MICELLAR NANOPARTICLES AND USES THEREOF Biorchestra Co., Ltd. (KR) 2025-05-14 EP disclosed
CN-114514038-B Micelle nanoparticle and use thereof 生物欧赛加有限责任公司 2024-08-06 CN disclosed
US-20240209035-A1 POLYNUCLEOTIDES CAPABLE OF ENHANCED PROTEIN EXPRESSION AND USES THEREOF BIORCHESTRA CO., LTD. (KR) 2024-06-27 US disclosed
WO-2024127317-A1 TREATING MITOCHONDRIAL DYSFUNCTION WITH MIRNA-485 INHIBITOR BIORCHESTRA CO., LTD. (KR) 2024-06-20 WO disclosed
US-20240173348-A1 MICELLAR NANOPARTICLES AND USES THEREOF BIORCHESTRA CO., LTD. (KR) 2024-05-30 US disclosed
US-20240131048-A1 MICELLAR NANOPARTICLES AND USES THEREOF BIORCHESTRA CO., LTD. (KR) 2024-04-25 US disclosed
US-20090076076-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF BAYLOR UNIVERSITY (US) 2009-03-19 US disclosed
US-7495023-B2 Thio semicarbazone and semicarbozone inhibitors of cysteine proteases and methods of their use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-02-24 US disclosed
US-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-08-23 US disclosed
EP-1734939-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE The Regents of The University of California (US) 2006-12-27 EP disclosed
US-20060128690-A1 Amine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-15 US disclosed
EP-1593667-A1 AMINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2005-11-09 EP disclosed
WO-2005087211-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-09-22 WO disclosed
US-20050182121-A1 Thio semicarbazone and semicarbozone inhibitors of cysteine proteases and methods of their use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-08-18 US disclosed
US-6897240-B2 Thio semicarbazone and semicarbazone inhibitors of cysteine proteases and methods of their use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-05-24 US disclosed
US-20040014801-A1 Thio semicarbazone and semicarbazone inhibitors of cysteine proteases and methods of their use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-01-22 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 (9 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-20040014801-A1 Thio semicarbazone and semicarbazone inhibitors of cysteine proteases and methods of their use CTSB, CTSS, CTSL MME 253/4885ACE 270/4885ACE2 546/4885
US-20050182121-A1 Thio semicarbazone and semicarbozone inhibitors of cysteine proteases and methods of their use CTSB, CTSS, CSTB MME 346/4885ACE 352/4885ACE2 609/4885
US-20240131048-A1 MICELLAR NANOPARTICLES AND USES THEREOF HNRNPLL, UACA, POLRMT MME 2393/4885ACE 4723/4885ACE2 4637/4885
US-20240209035-A1 POLYNUCLEOTIDES CAPABLE OF ENHANCED PROTEIN EXPRESSION AND USES THEREOF UPF1, PABPC4, NSUN3 MME 2493/4885ACE 4175/4885ACE2 2967/4885
US-20060128690-A1 Amine derivative MC1R, MC2R, MC4R MME 2936/4885ACE 3962/4885ACE2 2622/4885
US-20090076076-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTSB, CTSS, CTSZ MME 139/4885ACE 261/4885ACE2 468/4885
US-20250313835-A1 MICELLAR NANOPARTICLES AND USES THEREOF HNRNPLL, UACA, POLRMT MME 2393/4885ACE 4723/4885ACE2 4637/4885
US-20240173348-A1 MICELLAR NANOPARTICLES AND USES THEREOF TLR9, HNRNPLL, POLRMT MME 1940/4885ACE 4605/4885ACE2 4532/4885
US-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE CYP51A1, TUBA3C, PIGO MME 1087/4885ACE 1051/4885ACE2 1586/4885

“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.