SCHEMBL11906043

SCHEMBL11906043

CCOC(=O)C=CC1CC(c2ccccc2OC)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
DRD2 P14416 2/20 0.40
DRD4 P21917 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
HTR7 P34969 1/20 0.36
HCRTR2 O43614 1/20 0.36

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
SCHEMBL11906034 1.00 MEN1 (0.41) MEN1KMT2ADRD2DRD4L3MBTL1
SCHEMBL11906036 1.00 MEN1 (0.41) MEN1KMT2ADRD2DRD4L3MBTL1
SCHEMBL1659175 0.88 KMT2A (0.46) MEN1KMT2ADRD2DRD4L3MBTL1
SCHEMBL1659172 0.88 KMT2A (0.46) MEN1KMT2ADRD2DRD4L3MBTL1
SCHEMBL1659170 0.88 KMT2A (0.46) MEN1KMT2ADRD2DRD4L3MBTL1
SCHEMBL11919640 0.87 MEN1 (0.43) MEN1KMT2ADRD2DRD4TP53
SCHEMBL11906426 0.85 MEN1 (0.47) MEN1KMT2ADRD2DRD4TP53
SCHEMBL11921714 0.81 MEN1 (0.42) MEN1KMT2ADRD2DRD4KDM4E
SCHEMBL11919642 0.78 MEN1 (0.49) MEN1KMT2ADRD2DRD4TP53
SCHEMBL25706923 0.78 MEN1 (0.38) MEN1KMT2AL3MBTL1

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
EP-2488028-B1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2020-08-19 EP disclosed
CN-104945382-B Substituted piperidines that increase p53 activity and uses thereof 默沙东公司 2020-02-07 CN disclosed
US-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2014-11-13 US disclosed
US-8859776-B2 Substituted piperidines that increase p53 activity and the uses thereof MERCK SHARP & DOHME CORP. (US) 2014-10-14 US disclosed
US-20120208844-A1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME LLC 2012-08-16 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 (2 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-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF TP53, TP53BP1, MDM2 MEN1 2422/4885KMT2A 1436/4885DRD2 4173/4885
US-20120208844-A1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF TP53, MDM2, TP53BP1 MEN1 2208/4885KMT2A 1032/4885DRD2 4099/4885

“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.