SCHEMBL25190061

SCHEMBL25190061

COc1ccc(CN2CCN(C(=O)OC(C)(C)C)C(c3ccccc3Br)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.52
▸ SIGMAR1 Q99720 4/20 0.44
▸ DRD2 P14416 2/20 0.43
▸ DRD4 P21917 2/20 0.43
▸ NOTUM Q6P988 1/20 0.42
▸ HRH2 P25021 1/20 0.42
▸ MMP1 P03956 1/20 0.42
▸ MMP3 P08254 1/20 0.42
▸ MMP7 P09237 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP13 P45452 1/20 0.42
▸ FAAH O00519 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
SCHEMBL25188441 0.87 KDM4E (0.43) SIGMAR1DRD2DRD4HRH2FAAH
SCHEMBL25188272 0.87 SIGMAR1 (0.42) NR1H2SIGMAR1DRD2DRD4HRH2
SCHEMBL25197462 0.86 SIGMAR1 (0.42) NR1H2SIGMAR1DRD2DRD4HRH2
SCHEMBL25201526 0.85 SIGMAR1 (0.41) NR1H2SIGMAR1DRD2DRD4HRH2
SCHEMBL25188873 0.85 POLB (0.43) NR1H2SIGMAR1DRD2DRD4FAAH
SCHEMBL25189357 0.84 SMN1; SMN2 (0.48) SIGMAR1DRD2DRD4NOTUM
SCHEMBL25201553 0.82 SIGMAR1 (0.41) SIGMAR1DRD2DRD4HRH2FAAH
SCHEMBL25239306 0.78 NR1H2 (0.62) NR1H2
SCHEMBL27201543 0.78 NR1H2 (0.62) NR1H2
SCHEMBL3313724 0.74 NR1H2 (0.57) NR1H2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270210-A1 BCL-2 Inhibitor BEIGENE, LTD. (KY) 2025-08-28 — — US disclosed
US-12286430-B2 Bcl-2 inhibitor BEIGENE, LTD. (KY) 2025-04-29 — — US disclosed
US-20240376097-A1 BCL-2 Inhibitor BEIGENE LTD. (KY) 2024-11-14 — — US disclosed
CN-116969937-A BCL-2 inhibitors 百济神州有限公司 2023-10-31 — — CN disclosed
CN-116969936-A BCL-2 inhibitors 百济神州有限公司 2023-10-31 — — CN disclosed
CN-116802179-A BCL-2 inhibitors 百济神州有限公司 2023-09-22 — — CN disclosed
US-20230159522-A1 BCL-2 INHIBITOR BEONE MEDICINES I GMBH (CH) 2023-05-25 — — 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 (4 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-20250270210-A1 BCL-2 Inhibitor BCL2, BCL2A1, BCL2L1 NR1H2 760/4885SIGMAR1 4650/4885DRD2 3220/4885
US-20230159522-A1 BCL-2 INHIBITOR BCL2, BCL2A1, BCL2L1 NR1H2 760/4885SIGMAR1 4650/4885DRD2 3220/4885
US-20240376097-A1 BCL-2 Inhibitor BCL2, BCL2A1, BCL2L1 NR1H2 760/4885SIGMAR1 4650/4885DRD2 3220/4885
US-12286430-B2 Bcl-2 inhibitor BCL2, BCL2A1, BCL2L1 NR1H2 760/4885SIGMAR1 4650/4885DRD2 3220/4885

“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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