SCHEMBL25914101

SCHEMBL25914101

CC#CCN1CCO[C@@H](CN(C)C(=O)SC)C1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ EPHB4 P54760 1/20 0.32
▸ PDK1 Q15118 1/20 0.32
▸ CHRM2 P08172 1/20 0.30
▸ CHRM4 P08173 1/20 0.30
▸ CHRM5 P08912 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRM3 P20309 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
SCHEMBL26280385 0.89 CHRM2 (0.40) EPHA2KDREPHB4PDK1CHRM2
SCHEMBL26280393 0.89 CHRM2 (0.40) EPHA2KDREPHB4PDK1CHRM2
SCHEMBL22856065 0.83 EPHA2 (0.32) EPHA2KDREPHB4CHRM2CHRM4
SCHEMBL25705576 0.80 PIK3CD (0.36) PDK1
SCHEMBL24764073 0.80 PIK3CD (0.36) PDK1
SCHEMBL22861740 0.77 OPRL1 (0.31) PDK1
SCHEMBL24607395 0.77 EPHA2 (0.34) EPHA2KDREPHB4
SCHEMBL26280310 0.77 EPHA2 (0.35) EPHA2KDREPHB4
SCHEMBL25925700 0.77 EPHA2 (0.35) EPHA2KDREPHB4
SCHEMBL26406973 0.74 CACNA1H (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) 2023-07-27 — — 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-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF IRAK4, IRAK2, IRAK1 EPHA2 2192/4885KDR 1666/4885EPHB4 2422/4885

“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.

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