SCHEMBL29330578

SCHEMBL29330578

CCOC1CCC(CC(=O)N2CCN(C(C)C)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.42
▸ TPSAB1 Q15661 1/20 0.40
▸ TPSD1 Q9BZJ3 1/20 0.40
▸ TPSG1 Q9NRR2 1/20 0.40
▸ HRH3 Q9Y5N1 15/20 0.39
▸ KCNH2 Q12809 3/20 0.39
▸ CYP2D6 P10635 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CASP6 P55212 1/20 0.34

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
SCHEMBL18390493 0.88 NAMPT (0.51) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL26746724 0.86 NAMPT (0.42) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL29316801 0.86 NAMPT (0.42) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL25443839 0.83 HRH3 (0.48) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL18704939 0.78 HRH3 (0.47) NAMPTHRH3KCNH2CYP2D6
SCHEMBL20328001 0.77 KDM4E (0.50) NAMPTTPSAB1TPSD1TPSG1KDM4E
SCHEMBL14453896 0.76 HRH3 (0.45) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL12026454 0.76 NAMPT (0.43) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL18713080 0.75 NAMPT (0.45) NAMPTTPSAB1TPSD1TPSG1HRH3
SCHEMBL25443838 0.75 NAMPT (0.42) NAMPTTPSAB1TPSD1TPSG1HRH3

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 NAMPT 4770/4885TPSAB1 3740/4885TPSD1 4322/4885

“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.

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