SCHEMBL23579494

SCHEMBL23579494

CC(C)OC(=O)C(c1ccc(F)cc1)N1C[C@H](C)NC[C@H]1C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.46
▸ SLC6A3 Q01959 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC2 Q92769 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ IDO1 P14902 1/20 0.32

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
SCHEMBL25896635 0.91 SIGMAR1 (0.49) SIGMAR1SLC6A3MEN1KMT2A
SCHEMBL21910398 0.88 SIGMAR1 (0.48) SIGMAR1MEN1KMT2A
SCHEMBL21911488 0.84 SIGMAR1 (0.48) SIGMAR1
SCHEMBL6495242 0.78 SIGMAR1 (0.54) SIGMAR1SLC6A3KCNH2
SCHEMBL23579037 0.76 SIGMAR1 (0.47) SIGMAR1MEN1KMT2AKCNH2
SCHEMBL25138149 0.76 TACR1 (0.41) MEN1KMT2AHDAC2
SCHEMBL21910684 0.76 SIGMAR1 (0.46) SIGMAR1SLC6A3KCNH2
SCHEMBL21910678 0.75 SIGMAR1 (0.41) SIGMAR1GAAMEN1KMT2A
SCHEMBL21910438 0.75 SIGMAR1 (0.41) SIGMAR1SLC6A3MEN1KMT2A
Hydrochloric Acid SCHEMBL27171281 0.75 SIGMAR1 (0.41) SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12454531-B2 Substituted piperazine derivatives useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2025-10-28 — — US disclosed
CN-115175907-B Substituted piperazine derivatives useful as T cell activators 百时美施贵宝公司 2024-08-02 — — CN disclosed
US-20230118629-A1 SUBSTITUTED PIPERAZINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-04-20 — — US disclosed
US-20230118629-A1 SUBSTITUTED PIPERAZINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-04-20 — — US disclosed
CN-115175907-A Substituted piperazine derivatives useful as T cell activators 百时美施贵宝公司 2022-10-11 — — CN disclosed
WO-2021133749-A1 SUBSTITUTED PIPERAZINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-01 — — 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-20230118629-A1 SUBSTITUTED PIPERAZINE DERIVATIVES USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG SIGMAR1 2423/4885SLC6A3 4144/4885GAA 2836/4885
US-12454531-B2 Substituted piperazine derivatives useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 2423/4885SLC6A3 4144/4885GAA 2836/4885

“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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