SCHEMBL25524769

SCHEMBL25524769

C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1c1ccc(Nc2cc(Br)cn(C)c2=O)nc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.54
USP30 Q70CQ3 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
PIK3CA P42336 2/20 0.36
PRKDC P78527 2/20 0.36
MTOR P42345 1/20 0.36
CCND1 P24385 1/20 0.36
CDK6 Q00534 1/20 0.36
BRD4 O60885 1/20 0.35
SETD7 Q8WTS6 1/20 0.35
MKNK1 Q9BUB5 2/20 0.35

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
SCHEMBL30507867 1.00 BTK (0.54) BTKUSP30GPR119IDO1TDO2
SCHEMBL14925900 0.91 BTK (0.46) BTKUSP30GPR119IDO1TDO2
SCHEMBL29742073 0.89 BTK (0.45) BTKGPR119IDO1TDO2
SCHEMBL14912698 0.89 BTK (0.45) BTKGPR119IDO1TDO2
SCHEMBL14915914 0.89 BTK (0.45) BTKGPR119IDO1TDO2
SCHEMBL10256545 0.88 BTK (0.44) BTKUSP30GPR119IDO1TDO2
SCHEMBL25180233 0.87 BTK (0.42) BTKCCND1
SCHEMBL29230409 0.87 BTK (0.42) BTKCCND1
SCHEMBL29230406 0.87 BTK (0.42) BTKCCND1
SCHEMBL25525222 0.87 BTK (0.45) BTKUSP30IDO1TDO2PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12173008-B2 Substituted piperazines as BTK inhibitors HUTCHISON MEDIPHARMA LIMITED (CN) 2024-12-24 US disclosed
US-20230382916-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2023-11-30 US disclosed
US-20230382916-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2023-11-30 US disclosed
CN-116568687-A Heteroaryl heterocycles and uses thereof 和记黄埔医药(上海)有限公司 2023-08-08 CN disclosed
EP-4214206-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF Hutchison Medipharma Limited (CN) 2023-07-26 EP disclosed
US-11655254-B2 Substituted piperazines as BTK inhibitors HUTCHISON MEDIPHARMA LIMITED (CN) 2023-05-23 US disclosed
US-11655254-B2 Substituted piperazines as BTK inhibitors HUTCHISON MEDIPHARMA LIMITED (CN) 2023-05-23 US disclosed
US-20220332719-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-10-20 US disclosed
WO-2022057894-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-03-24 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 (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-20230382916-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF CYP3A43, CYP3A5, CYP3A7 BTK 1247/4885USP30 3965/4885GPR119 2684/4885
US-12173008-B2 Substituted piperazines as BTK inhibitors BTK, SYK, ABL1 BTK 1/4885USP30 2182/4885GPR119 2806/4885
US-11655254-B2 Substituted piperazines as BTK inhibitors BTK, SYK, LYN BTK 1/4885USP30 2357/4885GPR119 3028/4885
US-20220332719-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF BTK, SYK, LYN BTK 1/4885USP30 3367/4885GPR119 3107/4885

“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.