SCHEMBL29323908

SCHEMBL29323908

CC(C)OCCCC1CCN(CCC2CCN(C)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 2/20 0.38
GNAI3 P08754 1/20 0.38
GNAI1 P63096 1/20 0.38
KDM1A O60341 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
NCF1 P14598 1/20 0.35
CYP2D6 P10635 1/20 0.35
ACHE P22303 2/20 0.34
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 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
SCHEMBL25492962 0.92 NCF1 (0.41) GNAO1GNAI3GNAI1KDM1AHRH3
SCHEMBL29324792 0.91 CYP2D6 (0.38) GNAO1KDM1AHRH3CYP2D6SLC6A4
SCHEMBL26743216 0.89 HRH3 (0.45) GNAO1KDM1AHRH3CYP2D6ACHE
SCHEMBL26742225 0.88 KDM1A (0.36) GNAO1KDM1AHRH3CYP2D6SLC6A4
SCHEMBL29329947 0.88 SLC6A4 (0.40) GNAO1GNAI3GNAI1KDM1AHRH3
SCHEMBL29329914 0.87 GNAO1 (0.39) GNAO1GNAI3GNAI1HRH3NCF1
SCHEMBL26747096 0.84 HRH3 (0.39) GNAO1KDM1AHRH3CYP2D6SLC6A4
SCHEMBL26744662 0.84 NPY1R (0.37) GNAO1KDM1AHRH3CYP2D6SLC6A4
SCHEMBL26741830 0.84 HRH3 (0.48) GNAO1GNAI3GNAI1KDM1AHRH3
SCHEMBL20028304 0.83 NCF1 (0.35) KDM1ANCF1ACHECHRM2CHRM1

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 GNAO1 1574/4885GNAI3 169/4885GNAI1 205/4885

“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.