SCHEMBL119715

SCHEMBL119715

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

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.55
MDM4 O15151 2/20 0.47
TP53 P04637 2/20 0.47
KMT2A Q03164 2/20 0.47
MDM2 Q00987 1/20 0.46

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
SCHEMBL14265316 1.00 CASP3 (0.55) CASP3MDM4TP53KMT2AMDM2
SCHEMBL29402145 1.00 CASP3 (0.55) CASP3MDM4TP53KMT2AMDM2
SCHEMBL29400810 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2AMDM2
SCHEMBL14265315 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2AMDM2
SCHEMBL25268084 0.91 CASP3 (0.50) CASP3MDM4TP53KMT2AMDM2
SCHEMBL25206792 0.91 CASP3 (0.50) CASP3MDM4TP53KMT2AMDM2
SCHEMBL16060727 0.91 CASP3 (0.50) CASP3MDM4TP53KMT2AMDM2
SCHEMBL29400295 0.90 CASP3 (0.48) CASP3MDM4TP53KMT2AMDM2
SCHEMBL1959804 0.90 CASP3 (0.48) CASP3MDM4TP53KMT2AMDM2
SCHEMBL29666630 0.90 CASP3 (0.48) CASP3MDM4TP53KMT2AMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-20140039153-A1 CANCER IMAGING AND TREATMENT TECHNISCHE UNIVERSITAT MUNCHEN (DE) 2014-02-06 US disclosed
US-20140039153-A1 CANCER IMAGING AND TREATMENT TECHNISCHE UNIVERSITAT MUNCHEN (DE) 2014-02-06 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
US-20100240072-A1 Cancer Imaging and Treatment TECHNISCHE UNIVERSITAT MUNCHEN (DE) 2010-09-23 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US 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-20140039153-A1 CANCER IMAGING AND TREATMENT PNISR, S1PR3, S1PR1 CASP3 1977/4885MDM4 1915/4885TP53 60/4885
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 CASP3 2910/4885MDM4 1166/4885TP53 1635/4885
US-20100240072-A1 Cancer Imaging and Treatment PNISR, S1PR3, S1PR1 CASP3 1977/4885MDM4 1915/4885TP53 60/4885

“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.