SCHEMBL26406902

SCHEMBL26406902

CCCCCN1CCO[C@@H](CN(C)C(C)=O)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 7/20 0.44
▸ GUSB P08236 2/20 0.35
▸ EBP Q15125 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ EPHX1 P07099 1/20 0.34
▸ DRD3 P35462 4/20 0.34
▸ HTR1A P08908 3/20 0.34
▸ DRD1 P21728 3/20 0.34
▸ DRD4 P21917 3/20 0.34
▸ DRD5 P21918 3/20 0.34
▸ DRD2 P14416 2/20 0.33
▸ EPHA2 P29317 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ EPHB4 P54760 1/20 0.33

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
SCHEMBL26280366 0.96 BCHE (0.40) BCHEEPHX1DRD3HTR1ADRD1
SCHEMBL23559964 0.96 BCHE (0.40) BCHEEPHX1DRD3HTR1ADRD1
SCHEMBL24379958 0.91 DRD3 (0.41) BCHEDRD3
SCHEMBL26406909 0.87 BCHE (0.43) BCHEEBPSIGMAR1EPHX1DRD3
SCHEMBL22837769 0.86 BCHE (0.42) BCHEGUSBEBPSIGMAR1EPHX1
SCHEMBL25122901 0.86 BCHE (0.42) BCHEGUSBEBPSIGMAR1EPHX1
SCHEMBL25729879 0.86 BCHE (0.42) BCHEGUSBEBPSIGMAR1EPHX1
SCHEMBL25925738 0.86 OPRL1 (0.33) BCHE
SCHEMBL25925770 0.86 OPRL1 (0.33) BCHE
SCHEMBL22856498 0.85 CCR2 (0.41) DRD3

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-11779578-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-10-10 — — 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-11779578-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 BCHE 2634/4885GUSB 1746/4885EBP 3184/4885

“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.

Send feedback