SCHEMBL25422652

SCHEMBL25422652

O=CC(=O)C1CCC(N2Cc3cc(CN4CCN(C5CNC5)CC4)ccc3C2=O)CN1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 2/20 0.38
▸ HTR2C P28335 2/20 0.38
▸ HTR2B P41595 2/20 0.38
▸ IKZF2 Q9UKS7 5/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ PARP1 P09874 3/20 0.34
▸ PARP2 Q9UGN5 3/20 0.34
▸ GSPT1 P15170 1/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ IKZF3 Q9UKT9 1/20 0.34
▸ IKZF1 Q13422 1/20 0.34
▸ MAOA P21397 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL25421860 0.88 HTR2C (0.39) HTR2AHTR2CHTR2BIKZF2PARP1
SCHEMBL25421720 0.88 HTR2A (0.39) HTR2AHTR2CHTR2BIKZF2PARP1
SCHEMBL25422826 0.87 HTR2A (0.38) HTR2AHTR2CHTR2BIKZF2PARP1
SCHEMBL25422666 0.85 MAOA (0.35) HTR2AHTR2CHTR2BIKZF2PARP1
SCHEMBL25422761 0.85 MAOA (0.35) HTR2AHTR2CHTR2BIKZF2PARP1
SCHEMBL25281394 0.82 MAOA (0.38) HTR2AHTR2CHTR2BGSPT1DDB1
SCHEMBL25420240 0.82 PARP1 (0.39) IKZF2PARP1PARP2GSPT1DDB1
SCHEMBL25270702 0.82 CRBN (0.38) IKZF2PARP1PARP2CRBNIKZF3
Hydrochloric Acid SCHEMBL29099257 0.82 MAOA (0.41) HTR2AHTR2CHTR2BPARP1GSPT1
SCHEMBL25420904 0.81 HTR2A (0.39) HTR2AHTR2CHTR2BDPP4PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 — — WO claimed
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