SCHEMBL30458906

SCHEMBL30458906

O=C1c2cccc(CN3CCN(c4ccc(Cl)nn4)CC3)c2CN1C1CCCNC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 2/20 0.41
▸ EGLN1 Q9GZT9 2/20 0.41
▸ CRBN Q96SW2 5/20 0.40
▸ IKZF3 Q9UKT9 5/20 0.40
▸ HTR2B P41595 5/20 0.40
▸ HTR2A P28223 4/20 0.40
▸ HTR2C P28335 4/20 0.40
▸ PARP1 P09874 3/20 0.39
▸ TNK1 Q13470 2/20 0.39
▸ TNK2 Q07912 1/20 0.39
▸ HTR3E A5X5Y0 1/20 0.37
▸ HTR3B O95264 1/20 0.37
▸ HTR3A P46098 1/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.37
▸ HTR3D Q70Z44 1/20 0.37
▸ HTR3C Q8WXA8 1/20 0.37
▸ BPTF Q12830 1/20 0.37
▸ PANK3 Q9H999 2/20 0.34

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
SCHEMBL30459137 0.82 HTR2B (0.47) CRBNIKZF3HTR2BHTR2AHTR2C
SCHEMBL25421495 0.82 VEGFA (0.39) VEGFAEGLN1CRBNIKZF3PANK3
SCHEMBL30458859 0.81 PARP1 (0.46) VEGFAEGLN1HTR2BHTR2AHTR2C
SCHEMBL25647385 0.80 CRBN (0.58) CRBNIKZF3
SCHEMBL31076554 0.80 HTR2B (0.47) CRBNIKZF3HTR2BHTR2AHTR2C
SCHEMBL30458487 0.79 CRBN (0.42) CRBNIKZF3HTR2BHTR2AHTR2C
SCHEMBL30459293 0.77 HTR2B (0.47) HTR2BHTR2AHTR2CPARP1HTR3E
SCHEMBL30458409 0.76 HTR2B (0.44) CRBNIKZF3HTR2BHTR2AHTR2C
SCHEMBL30458971 0.76 HTR2B (0.44) CRBNIKZF3HTR2BHTR2AHTR2C
SCHEMBL30458453 0.76 HTR2B (0.47) CRBNIKZF3HTR2BHTR2AHTR2C

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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