SCHEMBL22650893

SCHEMBL22650893

CC(C)n1cnc2c1CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
ESR2 Q92731 1/20 0.43
NR1H2 P55055 1/20 0.43
GRAMD1A Q96CP6 1/20 0.42
PDK2 Q15119 1/20 0.39
HTT P42858 2/20 0.39
ATM Q13315 1/20 0.39
MAP3K5 Q99683 2/20 0.39
C5AR1 P21730 1/20 0.38
P2RX3 P56373 1/20 0.38
MAPK1 P28482 2/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADORA1 P30542 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
PARP1 P09874 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
PARP2 Q9UGN5 1/20 0.37

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
SCHEMBL1992279 0.83 MAPT (0.48) MAPTESR2NR1H2GRAMD1APDK2
SCHEMBL31079909 0.83 MAPT (0.48) MAPTESR2NR1H2GRAMD1APDK2
SCHEMBL21042236 0.80 ESR2 (0.44) MAPTESR2NR1H2GRAMD1APDK2
SCHEMBL28948295 0.79 ESR2 (0.45) MAPTESR2NR1H2PDK2P2RX3
SCHEMBL23852138 0.77 HCAR1 (0.50) MAPTESR2NR1H2PDK2ALDH1A1
SCHEMBL17868275 0.77 PDK2 (0.66) MAPTESR2NR1H2PDK2P2RX3
SCHEMBL14658484 0.76 MAPT (0.44) MAPTESR2NR1H2HTTATM
SCHEMBL30171174 0.76 MAPT (0.43) MAPTESR2NR1H2P2RX3GPR119
SCHEMBL14659735 0.75 ESR2 (0.46) MAPTESR2NR1H2PDK2P2RX3
SCHEMBL1996747 0.75 ESR2 (0.46) MAPTESR2NR1H2PDK2P2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040446-A CDK inhibitors 基因泰克公司 2025-05-27 CN disclosed
US-20220296595-A1 CDK INHIBITORS GENENTECH, INC. 2022-09-22 US disclosed
EP-3966213-A1 CDK INHIBITORS Qilu Regor Therapeutics Inc. (CN) 2022-03-16 EP disclosed
WO-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 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-20220296595-A1 CDK INHIBITORS CDKL1, CDK9, CDK6 MAPT 2167/4885ESR2 1878/4885NR1H2 2826/4885

“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.