SCHEMBL26520895

SCHEMBL26520895

CN1CCC(c2ccc(CCN3CCN(C)CC3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.54
SIGMAR1 Q99720 7/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
TMEM97 Q5BJF2 1/20 0.51
HRH3 Q9Y5N1 2/20 0.50
MEN1 O00255 1/20 0.49
TP53 P04637 1/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 1/20 0.49
DRD2 P14416 2/20 0.49
ACHE P22303 1/20 0.46
QDPR P09417 1/20 0.46

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
SCHEMBL15498535 0.81 LSS (0.55) LSSSIGMAR1CYP1A2CYP2D6MEN1
SCHEMBL19993063 0.81 LSS (0.55) LSSSIGMAR1CYP1A2CYP2D6MEN1
SCHEMBL19212128 0.81 LSS (0.55) LSSSIGMAR1CYP1A2CYP2D6MEN1
SCHEMBL10264241 0.79 LSS (0.59) LSSDRD2QDPR
SCHEMBL20630095 0.79 LSS (0.52) LSSSIGMAR1CYP1A2CYP2D6MEN1
SCHEMBL14081034 0.78 LSS (0.51) LSSSIGMAR1CYP1A2CYP2D6MEN1
SCHEMBL23173450 0.77 LSS (0.58) LSSSIGMAR1MEN1KMT2ADRD2
SCHEMBL21462239 0.77 LSS (0.62) LSSSIGMAR1MEN1KMT2ADRD2
SCHEMBL15177091 0.77 LSS (0.58) LSSSIGMAR1MEN1KMT2ADRD2
SCHEMBL2426347 0.77 LSS (0.58) LSSDRD2QDPR

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-20230322761-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEONE MEDICINES I GMBH (CH) 2023-10-12 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-20230322761-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BTK, CBL, LYN LSS 3469/4885SIGMAR1 4420/4885CYP1A2 4579/4885

“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.