SCHEMBL4288899

SCHEMBL4288899

CC(C)(C)OC(=O)N1CCN(c2ccc(N)cn2)C(=O)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.49
MAP4K4 O95819 1/20 0.45
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
CKS1B P61024 2/20 0.42
SKP1 P63208 2/20 0.42
SKP2 Q13309 2/20 0.42
GPR119 Q8TDV5 1/20 0.41
ADK P55263 1/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
POLB P06746 1/20 0.40
PTPN11 Q06124 1/20 0.39
ESR2 Q92731 1/20 0.39
ADORA1 P30542 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE7A Q13946 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL3402754 0.87 MAP4K4 (0.43) NR1H2MAP4K4DDB1CRBNCKS1B
SCHEMBL15205695 0.87 MAP4K4 (0.42) NR1H2MAP4K4DDB1CRBNCKS1B
SCHEMBL21360344 0.87 ENPP2 (0.45) NR1H2MAP4K4DDB1CRBNCKS1B
SCHEMBL29978453 0.86 HRH3 (0.45) NR1H2MAP4K4DDB1CRBNCKS1B
SCHEMBL28343832 0.86 HRH3 (0.45) NR1H2MAP4K4DDB1CRBNCKS1B
SCHEMBL1583767 0.86 GPR119 (0.46) NR1H2MAP4K4DDB1CRBNGPR119
SCHEMBL2710989 0.84 PANK3 (0.45) MAP4K4GPR119ADK
SCHEMBL265889 0.83 MAP4K4 (0.60) MAP4K4DDB1CRBNCKS1BSKP1
SCHEMBL29612182 0.83 MAP4K4 (0.60) MAP4K4DDB1CRBNCKS1BSKP1
SCHEMBL1583147 0.82 GPR119 (0.58) CKS1BSKP1SKP2GPR119SMARCA2

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
WO-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 WO disclosed
US-10807994-B2 Heterocyclic compounds and uses thereof NUVATION BIO INC. (US) 2020-10-20 US disclosed
US-20190106436-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2019-04-11 US disclosed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 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 (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-20190106436-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 NR1H2 4452/4885MAP4K4 990/4885DDB1 176/4885
US-10807994-B2 Heterocyclic compounds and uses thereof WEE1, WEE2, CCNE1 NR1H2 3894/4885MAP4K4 1074/4885DDB1 290/4885
US-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 NR1H2 3187/4885MAP4K4 54/4885DDB1 2875/4885

“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.