SCHEMBL2127667

SCHEMBL2127667

CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.51
POLB P06746 2/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 1/20 0.51
LMNA P02545 2/20 0.50
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CRBN Q96SW2 1/20 0.48
HDAC4 P56524 1/20 0.46
HPGD P15428 1/20 0.46
CNR2 P34972 1/20 0.45
GPR183 P32249 1/20 0.44

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
SCHEMBL16156045 0.91 CRBN (0.52) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL20765762 0.91 L3MBTL1 (0.62) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL3153203 0.83 SMN1; SMN2 (0.57) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL13646643 0.83 SMN1; SMN2 (0.60) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL13373550 0.81 HPGD (0.58) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL1065578 0.81 L3MBTL1 (0.59) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL13290557 0.81 KMT2A (0.51) MEN1KMT2APOLBCRBNHDAC4
SCHEMBL1063453 0.80 L3MBTL1 (0.57) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL1855879 0.80 HPGD (0.61) MEN1KMT2AL3MBTL1SMN1; SMN2POLB
SCHEMBL1855882 0.80 HPGD (0.61) MEN1KMT2AL3MBTL1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424843-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2014-03-26 EP disclosed
US-8598217-B2 Imidazole derivatives and their use as modulators of cyclin dependent kinases ASTEX THERAPEUTICS LTD. (GB) 2013-12-03 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
WO-2010125402-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2010-11-04 WO disclosed
US-7189739-B2 Compounds and methods to treat cardiac failure and other disorders SCIOS, INC. (US) 2007-03-13 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 (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-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES CDK3, CCNI, CDK1 MEN1 2006/4885KMT2A 745/4885L3MBTL1 3815/4885

“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.