SCHEMBL29323288

SCHEMBL29323288

CC(C)C1CCCN(C(C)CCC(C)N2CCN(C(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.31
OPRL1 P41146 2/20 0.31
CYP2D6 P10635 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL25952878 0.91 DRD2 (0.32) OPRM1OPRL1
SCHEMBL25129589 0.89 OPRM1 (0.35) OPRM1OPRL1CYP2D6HRH3
SCHEMBL26351186 0.87 OPRM1 (0.32) OPRM1OPRL1
SCHEMBL20243619 0.87 KAT2B (0.30)
SCHEMBL29342935 0.84
SCHEMBL23482195 0.84 OPRM1 (0.32) OPRM1OPRL1
SCHEMBL24942058 0.83 KDM4E (0.31)
SCHEMBL408518 0.83 DRD2 (0.36)
SCHEMBL408514 0.83 DRD2 (0.36)
SCHEMBL17189766 0.83 DRD2 (0.36)

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-20240238423-A9 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS Treeline Biosciences, Inc. 2024-07-18 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-20240238423-A9 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS BCL2A1, BCL2L1, BCL3 OPRM1 4583/4885OPRL1 4262/4885CYP2D6 1324/4885

“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.