SCHEMBL30459092

SCHEMBL30459092

O=C1c2ccc(CN3CC(N4CCNCC4)C3)cc2CN1C1CCCNC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 18/20 0.47
▸ HTR2B P41595 17/20 0.47
▸ HTR2A P28223 15/20 0.47
▸ PARP1 P09874 1/20 0.40
▸ IKZF2 Q9UKS7 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
SCHEMBL30790468 0.91 HTR2C (0.51) HTR2CHTR2BHTR2APARP1IKZF2
SCHEMBL30459017 0.88 HTR2C (0.46) HTR2CHTR2BHTR2APARP1IKZF2
SCHEMBL30458379 0.87 HTR2B (0.44) HTR2CHTR2BHTR2APARP1IKZF2
SCHEMBL30459129 0.87 HTR2B (0.44) HTR2CHTR2BHTR2APARP1IKZF2
SCHEMBL30790625 0.83 CRBN (0.47) HTR2CHTR2BHTR2APARP1
SCHEMBL2333387 0.82 HTR2B (0.49) HTR2CHTR2BHTR2APARP1
SCHEMBL30459711 0.81 HTR2B (0.47) HTR2CHTR2BHTR2APARP1
SCHEMBL25421720 0.81 HTR2A (0.39) HTR2CHTR2BHTR2APARP1IKZF2
SCHEMBL30459947 0.81 HTR2B (0.46) HTR2CHTR2BHTR2APARP1
SCHEMBL25647442 0.80 IKZF2 (0.56) IKZF2

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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