SCHEMBL120503

SCHEMBL120503

O=C(CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O)NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.55
MDM4 O15151 2/20 0.52
TP53 P04637 2/20 0.52
MDM2 Q00987 6/20 0.50
CASP3 P42574 2/20 0.46
KMT2A Q03164 2/20 0.46
SLC17A5 Q9NRA2 1/20 0.45

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
SCHEMBL29651368 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL29750297 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL13227676 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL31217659 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL1755686 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL29401774 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL29350848 1.00 TLR2 (0.55) TLR2MDM4TP53MDM2CASP3
SCHEMBL20592524 0.94 MDM2 (0.54) TLR2MDM4TP53MDM2CASP3
SCHEMBL20592527 0.94 MDM2 (0.54) TLR2MDM4TP53MDM2CASP3
SCHEMBL29759454 0.94 MDM2 (0.54) TLR2MDM4TP53MDM2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240218022-A1 ANTI-VISTA MACROCYCLIC PEPTIDES AND COMPOSITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-04 US disclosed
US-20230374034-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-11-23 US disclosed
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways AURIGENE ONCOLOGY LIMITED (IN) 2023-05-11 US disclosed
CN-115943151-A Process for the preparation of GLP-1/glucagon dual agonists 伊莱利利公司 2023-04-07 CN disclosed
CN-108794422-B Heterocyclic compounds as PD-L1 inhibitors 南京圣和药业股份有限公司 2022-07-01 CN disclosed
US-11331364-B2 Use for JNK inhibitor molecules for treatment of various diseases XIGEN INFLAMMATION LTD. (CY) 2022-05-17 US disclosed
US-11319347-B2 Peptide compound and method for producing same, composition for screening use, and method for selecting peptide compound FUJIFILM CORPORATION (JP) 2022-05-03 US disclosed
US-11149066-B2 Thrombospondin 1-binding peptide DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-10-19 US disclosed
US-20200131230-A1 THROMBOSPONDIN 1-BINDING PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-04-30 US disclosed
US-20200093883-A1 Use For JNK Inhibitor Molecules for Treatment of Various Diseases XIGEN INFLAMMATION LTD. (CY) 2020-03-26 US disclosed
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia SIRCAR JAGADISH C 2007-01-04 US disclosed
US-20050137138-A1 E2F activity-inhibiting compound KYOWA HAKKO KOGYO CO., LTD (JP) 2005-06-23 US disclosed
US-6713449-B1 E2F activity inhibitory compounds KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-03-30 US disclosed
US-20030055213-A1 Endothelin-antagonizing peptide TANAKA TAKEO (JP) 2003-03-20 US disclosed
US-20030027218-A1 PEPTIDES PROMOTING THE ACTIVATION OF LATENT TGF-BETA AND METHOD FOR SCREENING TGF-BETA ACTIVITY REGULATORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-02-06 US disclosed
US-6194195-B1 PURE CULTURE; FOR PRODUCTION OF HYPOTENSIVE AGENTS AND THERAPIES FOR ASTHMA, CEREBRAL APOPLEXY, ANGINA PECTORIS, ACUTE RENAL FAILURE, CARDIAC INFARCTION, AND CEREBRAL VASOSPASM KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-02-27 US disclosed
EP-0989136-A1 PEPTIDES HAVING CYCLIC STRUCTURES AND EXERTING P53 PROTEIN ACTIVTY-RESTORING EFFECT ON P53 PROTEIN MUTANTS KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-03-29 EP disclosed
EP-0963999-A1 E2F ACTIVITY INHIBITORY COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-12-15 EP disclosed
EP-0922710-A1 PEPTIDES PROMOTING THE ACTIVATION OF LATENT TGF-$g(b) AND METHOD FOR SCREENING TGF-$g(b) ACTIVITY REGULATORS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-06-16 EP disclosed
EP-0770623-A1 NOVEL CALCITONIN DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-05-02 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 (8 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-20230374034-A1 NOVEL BICYCLIC COMPOUNDS NOTCH1, NOTCH2, HES1 TLR2 3380/4885MDM4 4639/4885TP53 712/4885
US-11149066-B2 Thrombospondin 1-binding peptide SERPINC1, TEK, ARGLU1 TLR2 2737/4885MDM4 3675/4885TP53 4241/4885
US-20200131230-A1 THROMBOSPONDIN 1-BINDING PEPTIDE SERPINC1, TEK, ARGLU1 TLR2 2737/4885MDM4 3675/4885TP53 4241/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 TLR2 955/4885MDM4 4119/4885TP53 1709/4885
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia CETP, LDLR, NPC1L1 TLR2 2440/4885MDM4 4496/4885TP53 4543/4885
US-20240218022-A1 ANTI-VISTA MACROCYCLIC PEPTIDES AND COMPOSITIONS VIP, SGTA, NGLY1 TLR2 3449/4885MDM4 4261/4885TP53 1583/4885
US-11319347-B2 Peptide compound and method for producing same, composition for screening use, and method for selecting peptide compound VIP, NPPA, NGLY1 TLR2 3116/4885MDM4 4154/4885TP53 1409/4885
US-20030055213-A1 Endothelin-antagonizing peptide NPY1R, ECE1, EDNRB TLR2 2129/4885MDM4 4129/4885TP53 4032/4885

“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.