SCHEMBL29329974

SCHEMBL29329974

CC(C)OCCCC1CCN(CC2CN(C)C2)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.33
HRH3 Q9Y5N1 2/20 0.33
CYP2D6 P10635 1/20 0.32
ACHE P22303 2/20 0.31
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 3/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CCR5 P51681 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
SCHEMBL26753582 0.87 CCR5 (0.32) KDM1ACCR5
SCHEMBL20028833 0.84 NCF1 (0.35) KDM1AACHE
SCHEMBL20028304 0.84 NCF1 (0.35) KDM1AACHE
SCHEMBL19477247 0.84 NCF1 (0.35) KDM1AACHE
SCHEMBL26743216 0.83 HRH3 (0.45) KDM1AHRH3CYP2D6ACHESLC6A4
SCHEMBL25492962 0.82 NCF1 (0.41) KDM1AHRH3ACHE
SCHEMBL26746739 0.82 HRH3 (0.35) KDM1AHRH3ACHEHTR2AHTR2C
SCHEMBL29324792 0.82 CYP2D6 (0.38) KDM1AHRH3CYP2D6SLC6A2SLC6A4
SCHEMBL29323908 0.82 GNAO1 (0.38) KDM1AHRH3CYP2D6ACHESLC6A4
SCHEMBL26744662 0.82 NPY1R (0.37) KDM1AHRH3CYP2D6SLC6A2SLC6A4

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 KDM1A 1195/4885HRH3 4026/4885CYP2D6 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.