SCHEMBL30008807

SCHEMBL30008807

COC(=O)C(CC1CC1)N1CCC2(CCCN2C(=O)OC(C)(C)C)C1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.48
GRIN2C Q14957 1/20 0.48
CDK4 P11802 1/20 0.35
CNR2 P34972 2/20 0.33
BACE1 P56817 3/20 0.32
KDM1A O60341 2/20 0.32
JAK3 P52333 2/20 0.32
YAP1 P46937 1/20 0.31
HSD11B1 P28845 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TRPV3 Q8NET8 1/20 0.30
KDM4E B2RXH2 1/20 0.30
PKM P14618 1/20 0.30
CTSD P07339 1/20 0.30
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 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
SCHEMBL30008265 1.00 GRIN2B (0.48) GRIN2BGRIN2CCDK4CNR2BACE1
SCHEMBL30310450 0.97 GRIN2B (0.46) GRIN2BGRIN2CCDK4CNR2BACE1
SCHEMBL24740317 0.90 GRIN2B (0.50) GRIN2BGRIN2CCDK4CNR2BACE1
SCHEMBL24113112 0.87 GRIN2B (0.47) GRIN2BGRIN2CCDK4CNR2JAK3
SCHEMBL3535138 0.82 GRIN2B (0.57) GRIN2BGRIN2CCDK4JAK3
SCHEMBL3533735 0.82 GRIN2B (0.57) GRIN2BGRIN2CCDK4JAK3
SCHEMBL3535136 0.82 GRIN2B (0.57) GRIN2BGRIN2CCDK4JAK3
SCHEMBL3534085 0.82 GRIN2B (0.57) GRIN2BGRIN2CCDK4JAK3
SCHEMBL18121987 0.79 GRIN2B (0.60) GRIN2BGRIN2CCDK4JAK3TRPV3
SCHEMBL19852936 0.78 GRIN2B (0.61) GRIN2BGRIN2CCDK4KDM1AJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4161902-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2023-04-12 EP disclosed
US-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2022-12-13 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-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof CTRL, CTSV, CTSL GRIN2B 4555/4885GRIN2C 3506/4885CDK4 1078/4885

“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.