SCHEMBL24775562

SCHEMBL24775562

NCCCC(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 13/20 0.59
▸ WNT3A P56704 13/20 0.59
▸ LMNA P02545 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ HDAC3 O15379 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ PTGS1 P23219 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
SCHEMBL31525070 1.00 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL30089582 0.86 CTNNB1 (0.75) CTNNB1WNT3ALMNAGAA
SCHEMBL5851305 0.85 CTNNB1 (0.60) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL5543911 0.83 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL3732487 0.83 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAA
SCHEMBL8232789 0.82 CTNNB1 (0.57) CTNNB1WNT3ALMNAGAAPTGS1
SCHEMBL5660835 0.82 CTNNB1 (0.58) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL27629360 0.82 CTNNB1 (0.57) CTNNB1WNT3ALMNAGAA
SCHEMBL5540580 0.82 CTNNB1 (0.57) CTNNB1WNT3ALMNAGAAHDAC3
Ammonia Solution, Strong SCHEMBL28847475 0.81 CTNNB1 (0.55) CTNNB1WNT3ALMNAGAAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 — — CN disclosed
CN-117430601-A Bcl-2 inhibitors 百济神州有限公司 2024-01-23 — — CN disclosed
CN-112437772-B Bcl-2 inhibitors 百济神州有限公司 2023-11-21 — — CN disclosed
US-20220402915-A1 BCL-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2022-12-22 — — US disclosed
CN-112437772-A Bcl-2 inhibitors 百济神州有限公司 2021-03-02 — — CN 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-20220402915-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 CTNNB1 2247/4885WNT3A 3061/4885LMNA 2914/4885

“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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