SCHEMBL630652

SCHEMBL630652

CC(C)(C)OC(=O)Nc1cc2cc(Br)ccc2cc1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 10/20 0.46
LMNA P02545 2/20 0.44
USP2 O75604 1/20 0.44
CCR5 P51681 2/20 0.44
CYP2C9 P11712 1/20 0.43
PTGER1 P34995 1/20 0.43
AAK1 Q2M2I8 2/20 0.42
BRD4 O60885 2/20 0.42

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
SCHEMBL30026828 1.00 LRRK2 (0.46) LRRK2LMNAUSP2CCR5CYP2C9
SCHEMBL629633 0.89 ALOX5 (0.47) CYP2C9PTGER1BRD4
SCHEMBL2993578 0.87 TACR3 (0.46) LRRK2CYP2C9PTGER1BRD4
SCHEMBL23541164 0.85 LRRK2 (0.49) LRRK2LMNAUSP2BRD4
SCHEMBL32667255 0.79 CYP2C9 (0.47) LRRK2LMNAUSP2CCR5CYP2C9
SCHEMBL22412007 0.79 PTGER1 (0.47) LRRK2LMNAUSP2PTGER1
SCHEMBL11959262 0.78 BRD4 (0.51) LRRK2CYP2C9PTGER1BRD4
SCHEMBL27745072 0.78 LMNA (0.46) LRRK2LMNAUSP2CCR5PTGER1
SCHEMBL23270090 0.78 CCR5 (0.46) LRRK2LMNAUSP2CCR5BRD4
SCHEMBL31277431 0.78 LRRK2 (0.46) LRRK2LMNAUSP2CCR5BRD4

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116194453-A Protein tyrosine phosphatase degrading agent and method of use thereof 卡里科生命科学有限责任公司 2023-05-30 CN disclosed
WO-2022271727-A1 DEGRADER COMPOUNDS AND USES THEREOF CALICO LIFE SCIENCES LLC (US) 2022-12-29 WO disclosed
WO-2021127586-A1 PROTEIN TYROSINE PHOSPHATASE DEGRADERS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2021-06-24 WO disclosed
US-8252820-B2 1-orthofluorophenyl substituted 1,2,5-thiazolidinedione derivatives as PTP-as inhibitors NOVARTIS AG (CH) 2012-08-28 US disclosed
EP-1963292-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-02-22 EP disclosed
US-20100197744-A1 Organic Compounds BARNES DAVID 2010-08-05 US disclosed
US-7700633-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
EP-2155704-A1 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS Novartis Ag (CH) 2010-02-24 EP disclosed
US-20100035942-A1 1-orthofluorophenyl substituted 1,2,5-thiazolidinedione derivatives as ptp-as inhibitors NOVARTIS AG (CH) 2010-02-11 US disclosed
WO-2008148744-A1 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS NOVARTIS AG (CH) 2008-12-11 WO disclosed
US-20080262050-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-23 US disclosed
EP-1963292-A2 ORGANIC COMPOUNDS Novartis Pharma AG (CH) 2008-09-03 EP disclosed
EP-1963293-A1 1-ORTHOFLUOROPHENYL SUBSTITUTED 1, 2 , 5-THIAZOLIDINEDIONE DERIVATIVES AS PTP-AS INHIBITORS Novartis AG (CH) 2008-09-03 EP disclosed
WO-2007067615-A2 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS NOVARTIS AG (CH) 2007-06-14 WO disclosed
WO-2007067612-A1 1-ORTHOFLUOROPHENYL SUBSTITUTED 1, 2, 5-THIAZOLIDINEDIONE DERIVATIVES AS PTP-AS INHIBITORS NOVARTIS AG (CH) 2007-06-14 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 (3 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-20100197744-A1 Organic Compounds PTPRS, PTPRO, PTPRC LRRK2 453/4885LMNA 4846/4885USP2 432/4885
US-20080262050-A1 Organic Compounds PTPRS, PTPRO, PTPRC LRRK2 338/4885LMNA 4839/4885USP2 753/4885
US-20100035942-A1 1-orthofluorophenyl substituted 1,2,5-thiazolidinedione derivatives as ptp-as inhibitors PTPRS, PTPRF, PTPRO LRRK2 359/4885LMNA 4853/4885USP2 854/4885

“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.