SCHEMBL25176367

SCHEMBL25176367

COc1ccc(C(=O)N2CCC(CN3CCN(c4ccc(Nc5nccc(-c6ccc(CNC(=O)N7CC(OC(C)C)C7)c(C)c6)n5)cc4)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 14/20 0.51
▸ JAK2 O60674 4/20 0.51
▸ CD69 Q07108 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ HRH2 P25021 1/20 0.51
▸ CDK7 P50613 1/20 0.51
▸ AAK1 Q2M2I8 1/20 0.51
▸ MAP3K19 Q56UN5 1/20 0.51
▸ CDKL2 Q92772 1/20 0.51
▸ RIOK1 Q9BRS2 1/20 0.51
▸ RIOK2 Q9BVS4 1/20 0.51
▸ BMP2K Q9NSY1 1/20 0.51
▸ SOS1 Q07889 2/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ TBK1 Q9UHD2 1/20 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
SCHEMBL30434288 1.00 BTK (0.51) BTKJAK2CD69CYP3A4HRH2
SCHEMBL25173935 0.91 BTK (0.53) BTKJAK2CD69CYP3A4HRH2
SCHEMBL31169600 0.91 BTK (0.53) BTKJAK2CD69CYP3A4HRH2
SCHEMBL31169613 0.90 BTK (0.59) BTKJAK2CD69CYP3A4HRH2
SCHEMBL25170795 0.90 BTK (0.59) BTKJAK2CD69CYP3A4HRH2
SCHEMBL25170622 0.87 BTK (0.56) BTKJAK2CD69CYP3A4HRH2
SCHEMBL31169602 0.87 BTK (0.56) BTKJAK2CD69CYP3A4HRH2
SCHEMBL25167760 0.87 BTK (0.56) BTKJAK2CD69CYP3A4HRH2
SCHEMBL30434245 0.87 BTK (0.56) BTKJAK2CD69CYP3A4HRH2
SCHEMBL25170727 0.85 SOS1 (0.37) BTKJAK2CD69CYP3A4HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4428130-A1 COMPOUND HAVING BTK PROTEIN DEGRADATION ACTIVITY, AND MEDICAL USES THEREOF Ubix Therapeutics, Inc. (KR) 2024-09-11 — — EP claimed
EP-4428130-A1 COMPOUND HAVING BTK PROTEIN DEGRADATION ACTIVITY, AND MEDICAL USES THEREOF Ubix Therapeutics, Inc. (KR) 2024-09-11 — — EP disclosed
CN-118159532-A Compound with BTK protein degradation activity and medical application thereof 尤比克斯治疗公司 2024-06-07 — — CN disclosed
WO-2023080732-A1 COMPOUND HAVING BTK PROTEIN DEGRADATION ACTIVITY, AND MEDICAL USES THEREOF 주식회사 유빅스테라퓨틱스 2023-05-11 — — WO disclosed
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