SCHEMBL22650416

SCHEMBL22650416

CN(C(=O)OC(C)(C)C)C1CCNC(=O)C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
BUB1 O43683 1/20 0.36
ASGR1 P07306 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
PDE10A Q9Y233 1/20 0.33
SPR P35270 6/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
USP30 Q70CQ3 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL135183 0.79 HSD11B1 (0.42) HSD11B1DDB1CRBNBUB1ASGR1
Hydrochloric Acid SCHEMBL8054576 0.78 HSD11B1 (0.41) HSD11B1DDB1CRBNBUB1ASGR1
Hydrochloric Acid SCHEMBL18824762 0.78 HSD11B1 (0.41) HSD11B1DDB1CRBNBUB1ASGR1
SCHEMBL65492 0.76 SLC6A4 (0.42) HSD11B1
SCHEMBL31344262 0.76 HSD11B1 (0.40) HSD11B1DDB1CRBNBUB1ASGR1
SCHEMBL25512753 0.76 HSD11B1 (0.40) HSD11B1DDB1CRBNBUB1ASGR1
SCHEMBL5370355 0.76 HSD11B1 (0.40) HSD11B1DDB1CRBNBUB1ASGR1
SCHEMBL1033810 0.76 SLC6A4 (0.42) HSD11B1
SCHEMBL181909 0.76 SLC6A4 (0.42) HSD11B1
SCHEMBL190837 0.76 HSD11B1 (0.47) HSD11B1DDB1CRBNBUB1ASGR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220296595-A1 CDK INHIBITORS GENENTECH, INC. 2022-09-22 US disclosed
CN-114364675-A CDK inhibitors 上海齐鲁锐格医药研发有限公司 2022-04-15 CN 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 HSD11B1 726/4885DDB1 250/4885CRBN 1920/4885

“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.