SCHEMBL939400

SCHEMBL939400

CC(C)C[C@H](Nc1ccccc1)[C@@H](O)CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ PSMB5 P28074 3/20 0.44
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ REN P00797 5/20 0.40
▸ PSMB8 P28062 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MMP8 P22894 1/20 0.37

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
SCHEMBL16569135 1.00 LMNA (0.45) LMNAHPGDALDH1A1CYP3A4ALOX15
SCHEMBL31003034 0.79 PSMB5 (0.48) ALDH1A1PSMB5SMN1; SMN2RENPSMB8
SCHEMBL5860469 0.78 ADAMTS4 (0.51) LMNAHPGDALDH1A1CYP3A4ALOX15
SCHEMBL5860476 0.78 ADAMTS4 (0.51) LMNAHPGDALDH1A1CYP3A4ALOX15
SCHEMBL29885722 0.78 CACNA2D1 (0.42) ALDH1A1TDP1
SCHEMBL31633387 0.78 METAP2 (0.41) PSMB5RENPSMB8
SCHEMBL2695428 0.76 CACNA2D1 (0.44) ALDH1A1PSMB5TDP1
SCHEMBL30442889 0.76 CACNA2D1 (0.44) ALDH1A1TDP1
SCHEMBL31515453 0.75 PEPD (0.38) LMNAHPGDALDH1A1CYP3A4TSHR
SCHEMBL9193585 0.75 LMNA (0.38) LMNAALDH1A1HIF1AREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514408-B1 β-secretase enzyme compositions and methods ELAN PHARMACEUTICALS, INC. (US) 2009-04-07 — — US claimed
US-20060128963-A1 Piperidine derivatives as melanocortin-4 receptor agonists MERCK SHARP & DOHME CORP. 2006-06-15 — — US claimed
EP-1648457-A2 PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co., Inc. (US) 2006-04-26 — — EP claimed
WO-2005009950-A2 PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2005-02-03 — — WO claimed
US-6833471-B2 Contacting beta-ketodiester having ketone and two esters with a ketoreductase under conditions permitting reduction of ketone to alcohol, regioselectively hydrolyzing one of ester groups to acid, converting acid or ester to amine BIOCATALYTICS, INC. 2004-12-21 — — US claimed
US-20040053377-A1 Methods for producing hydroxy amino acids and derivatives thereof CODEXIS, INC. 2004-03-18 — — US claimed
US-20260125418-A1 A COMPOUND AND ITS USE FOR DETECTING A DISEASE IN THE EXHALED BREATH OF A SUBJECT OWLSTONE MED LTD (GB) 2026-05-07 — — US disclosed
EP-4618952-A2 METHODS FOR TREATING OBESITY WITH AN MC4R AGONIST Rhythm Pharmaceuticals, Inc. (US) 2025-09-24 — — EP disclosed
EP-4598592-A1 A COMPOUND AND ITS USE FOR DETECTING A DISEASE IN THE EXHALED BREATH OF A SUBJECT Owlstone Medical Limited (GB) 2025-08-13 — — EP disclosed
CN-119585256-A Chemokine receptor modulators and uses thereof 拉普特医疗公司 2025-03-07 — — CN disclosed
CN-119365493-A Anti-CD 84 antibodies and uses thereof 希望之城公司 2025-01-24 — — CN disclosed
US-20240325561-A1 PEGYLATED DRUG-LINKERS FOR IMPROVED LIGAND-DRUG CONJUGATE PHARMACOKINETICS SEAGEN INC (US) 2024-10-03 — — US disclosed
WO-2024108198-A2 METHODS OF TREATING OBESITY WITH AN MC4R AGONIST RHYTHM PHARMACEUTICALS, INC. (US) 2024-05-23 — — WO disclosed
US-6833471-B2 Contacting beta-ketodiester having ketone and two esters with a ketoreductase under conditions permitting reduction of ketone to alcohol, regioselectively hydrolyzing one of ester groups to acid, converting acid or ester to amine BIOCATALYTICS, INC. 2004-12-21 — — US disclosed
US-6833471-B2 Contacting beta-ketodiester having ketone and two esters with a ketoreductase under conditions permitting reduction of ketone to alcohol, regioselectively hydrolyzing one of ester groups to acid, converting acid or ester to amine BIOCATALYTICS, INC. 2004-12-21 — — US disclosed
US-20040053377-A1 Methods for producing hydroxy amino acids and derivatives thereof CODEXIS, INC. 2004-03-18 — — US disclosed
US-20040053377-A1 Methods for producing hydroxy amino acids and derivatives thereof CODEXIS, INC. 2004-03-18 — — US disclosed
EP-0912600-A2 PEPTIDOMIMETIC INHIBITORS OF CATHEPSIN D AND PLASMEPSINS I AND II THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-05-06 — — EP disclosed
US-5849691-A Peptidomimetic inhibitors of cathepsin D and plasmepsins I and II THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-12-15 — — US disclosed
WO-1997030072-A1 PEPTIDOMIMETIC INHIBITORS OF CATHEPSIN D AND PLASMEPSINS I AND II THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-08-21 — — 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 (4 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-20040053377-A1 Methods for producing hydroxy amino acids and derivatives thereof HMGCR, HSD17B12, BCKDK LMNA 3159/4885HPGD 61/4885ALDH1A1 514/4885
US-20260125418-A1 A COMPOUND AND ITS USE FOR DETECTING A DISEASE IN THE EXHALED BREATH OF A SUBJECT BRCA1, L3MBTL1, LMNA LMNA 3/4885HPGD 1055/4885ALDH1A1 1039/4885
US-20060128963-A1 Piperidine derivatives as melanocortin-4 receptor agonists MC4R, MC5R, MC1R LMNA 4631/4885HPGD 2186/4885ALDH1A1 2981/4885
US-20240325561-A1 PEGYLATED DRUG-LINKERS FOR IMPROVED LIGAND-DRUG CONJUGATE PHARMACOKINETICS EGFR, HDGF, CD47 LMNA 155/4885HPGD 1979/4885ALDH1A1 1001/4885

“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.

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