Sugi Predict

Sugi Predict / Compounds / SCHEMBL441305

SCHEMBL441305

SCHEMBL441305

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 5/20 0.67
▸ PPARG P37231 4/20 0.67
▸ ACE P12821 2/20 0.60
▸ ITGB3 P05106 2/20 0.60
▸ ITGA2B P08514 2/20 0.60
▸ CTSS P25774 6/20 0.56
▸ CTSK P43235 5/20 0.56
▸ FPR2 P25090 1/20 0.55
▸ CTSL P07711 1/20 0.53
▸ CTSB P07858 1/20 0.53
▸ PTPN1 P18031 2/20 0.52
▸ MME P08473 1/20 0.52
▸ CPA1 P15085 1/20 0.52
▸ ACE2 Q9BYF1 1/20 0.52
▸ ITGA4 P13612 1/20 0.52
▸ ITGB7 P26010 1/20 0.52
▸ PPARD Q03181 2/20 0.50
▸ ITGB1 P05556 1/20 0.50
▸ ITGAV P06756 1/20 0.50
▸ ITGB5 P18084 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
SCHEMBL3556235 1.00 PPARA (0.67) PPARAPPARGACEITGB3ITGA2B
SCHEMBL1519728 1.00 PPARA (0.67) PPARAPPARGACEITGB3ITGA2B
SCHEMBL1595805 0.92 ACE (0.60) PPARAPPARGACEITGB3ITGA2B
SCHEMBL22962065 0.92 ACE (0.61) PPARAPPARGACEITGB3ITGA2B
SCHEMBL3735627 0.91 CTSS (0.63) PPARAPPARGACEITGB3ITGA2B
SCHEMBL3735628 0.91 CTSS (0.63) PPARAPPARGACEITGB3ITGA2B
SCHEMBL8112750 0.90 PPARG (0.60) PPARAPPARGACEITGB3ITGA2B
SCHEMBL4468471 0.89 ACE (0.62) PPARAPPARGACEITGB3ITGA2B
SCHEMBL14250514 0.89 ACE (0.62) PPARAPPARGACEITGB3ITGA2B
SCHEMBL4004856 0.89 ACE (0.62) PPARAPPARGACEITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104910046-B Phenylacetylene derivative with double chiral carbon atoms on pendant group and preparation method and application thereof 哈尔滨工程大学 2017-05-24 — — CN claimed
CN-104910039-A Functional phenylacetylene compound and preparation method thereof UNIV HARBIN ENG 2015-09-16 — — CN claimed
EP-4702033-A1 DESMURAMYLPEPTIDE DIACIDS AS NOD2 AGONISTS AND USE THEREOF Imhotex Limited (GB) 2026-03-04 — — EP disclosed
US-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PEPTIDREAM INC (JP) 2026-01-15 — — US disclosed
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME NEW YORK UNIVERSITY (US) 2026-01-01 — — US disclosed
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 — — US disclosed
US-12371461-B2 Nemo coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2025-07-29 — — US disclosed
EP-3303367-B1 STABILIZED MINIMAL COILED-COIL MIMETICS UNIV NEW YORK (US) 2025-06-18 — — EP disclosed
EP-4534524-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PeptiDream Inc. (JP) 2025-04-09 — — EP disclosed
WO-2024224086-A1 DESMURAMYLPEPTIDE DIACIDS AS NOD2 AGONISTS AND USE THEREOF Imhotex Limited (GB) 2024-10-31 — — WO disclosed
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME UNIV NEW YORK (US) 2024-06-13 — — US disclosed
US-20050080074-A1 Modulators of serotonin receptors BRISTOL-MYERS SQUIBB COMPANY 2005-04-14 — — US disclosed
US-20040186151-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-23 — — US disclosed
WO-2004071448-A2 SUBSTITUTED AZOLE DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES TRANSTECH PHARMA INC. (US) 2004-08-26 — — WO disclosed
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 — — US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 — — EP disclosed
US-5376635-A A polypeptides as diuretics, hypotensive agents BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-12-27 — — US disclosed
EP-0283956-B1 FLUORINE CONTAINING ATRIAL NATRIURETIC PEPTIDES BIO-MEGA INC. (CA) 1992-11-11 — — EP disclosed
US-5095004-A Hypotensives, diuretics BIO-MEGA INC. (CA) 1992-03-10 — — US disclosed
EP-0283956-A2 Fluorine containing atrial natriuretic peptides BIO-MEGA INC. (CA) 1988-09-28 — — 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 (7 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-12371461-B2 Nemo coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH PPARA 4497/4885PPARG 4002/4885ACE 4652/4885
US-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF NSUN3, BCAT1, SLC43A1 PPARA 2794/4885PPARG 3131/4885ACE 1944/4885
US-20050080074-A1 Modulators of serotonin receptors HTR5A, HTR1A, HTR2B PPARA 850/4885PPARG 444/4885ACE 3230/4885
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME DDX21, PHAX, RBX1 PPARA 3778/4885PPARG 3003/4885ACE 4863/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R PPARA 3215/4885PPARG 3973/4885ACE 621/4885
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME COIL, CALCOCO2, NCAPH PPARA 4462/4885PPARG 4013/4885ACE 4653/4885
US-20040186151-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ PPARA 2236/4885PPARG 2024/4885ACE 368/4885

“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.