SCHEMBL5064869

SCHEMBL5064869

CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.49
NAMPT P43490 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NR1D1 P20393 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
PRMT5 O14744 2/20 0.43
WDR77 Q9BQA1 2/20 0.43
MAPK1 P28482 1/20 0.42
PTPN1 P18031 1/20 0.42
ACE P12821 2/20 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
SCHEMBL4595926 1.00 OPRD1 (0.49) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL29163531 1.00 OPRD1 (0.49) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL29401750 1.00 OPRD1 (0.49) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL894542 0.88 OPRD1 (0.47) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL9543966 0.88 OPRD1 (0.47) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL31359949 0.88 MEN1 (0.53) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL31158720 0.88 MEN1 (0.53) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL2081318 0.88 MEN1 (0.53) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL10207323 0.88 OPRD1 (0.50) OPRD1NAMPTMEN1KMT2ANR1D1
SCHEMBL3929271 0.88 MEN1 (0.53) OPRD1NAMPTMEN1KMT2ANR1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117486762-A Novel compound and use method and application thereof 中国医学科学院医药生物技术研究所 2024-02-02 CN disclosed
EP-3381913-B1 2-(((PYRROLIDIN-3-YL)CARBONYL)AMINO)-1H-IMIDAZOLE DERIVATIVES AS MELANOCORTIN RECEPTOR 1 (MCR1) AGONISTS FOR TREATING RHEUMATOID ARTHRITIS MITSUBISHI TANABE PHARMA CORP (JP) 2021-03-31 EP disclosed
WO-2017090743-A1 NOVEL IMIDAZOLE COMPOUND AND USE THEREOF AS MELANOCORTIN RECEPTOR AGONIST 田辺三菱製薬株式会社 2017-06-01 WO disclosed
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 US disclosed
WO-1993020099-A2 CCK AND/OR GASTRIN RECEPTOR LIGANDS FERRING B.V. (NL) 1993-10-14 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 (1 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-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 OPRD1 4277/4885NAMPT 1215/4885MEN1 3151/4885

“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.