SCHEMBL26637453

SCHEMBL26637453

O=C(O)[C@H]1CC[C@H](Oc2cccc(Br)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.52
▸ SLC6A4 P31645 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52
▸ ACSL1 P33121 11/20 0.51
▸ ACSL3 O95573 1/20 0.50
▸ ACSL6 Q9UKU0 1/20 0.50
▸ LNPEP Q9UIQ6 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL26637455 1.00 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3ACSL1ACSL3
SCHEMBL29711702 0.85 SLC6A4 (0.67) SLC6A2SLC6A4SLC6A3LNPEP
SCHEMBL1416985 0.85 SLC6A4 (0.67) SLC6A2SLC6A4SLC6A3LNPEP
SCHEMBL30663064 0.84 SLC6A4 (0.49) SLC6A2SLC6A4SLC6A3ACSL1LNPEP
SCHEMBL1749499 0.82 ACSL1 (0.56) SLC6A2SLC6A4SLC6A3ACSL1ACSL3
SCHEMBL664031 0.82 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3ACSL1ACSL3
SCHEMBL10147937 0.82 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3ACSL1ACSL3
SCHEMBL25184897 0.81 POLB (0.51) ACSL1ACSL3ACSL6EPHX2
SCHEMBL25184896 0.81 POLB (0.51) ACSL1ACSL3ACSL6EPHX2
SCHEMBL15637209 0.79 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3KMT2AKDM4E

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 3 patents. 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
US-20230390404-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS TREELINE BIOSCIENCES INC (US) 2023-12-07 — — US disclosed
WO-2023215482-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS Treeline Biosciences, Inc. (US) 2023-11-09 — — WO 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 (2 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 SLC6A2 2797/4885SLC6A4 3815/4885SLC6A3 2601/4885
US-20230390404-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS BCL2A1, BCL2L1, BCL3 SLC6A2 2797/4885SLC6A4 3815/4885SLC6A3 2601/4885

“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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