SCHEMBL30824889

SCHEMBL30824889

CCS(=O)(=O)c1ccc(Oc2cccc(OCCN3CCN(C(=O)OC(C)(C)C)CC3)c2F)c(-c2cn(C)c(=O)c3c2ccn3S(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 19/20 0.45
▸ HTR6 P50406 1/20 0.39

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
SCHEMBL27390622 0.84 BRD4 (0.65) BRD4
SCHEMBL30824896 0.84 BRD4 (0.65) BRD4
SCHEMBL30824891 0.84 BRD4 (0.65) BRD4
SCHEMBL30811964 0.83 BRD4 (0.42) BRD4HTR6
SCHEMBL30812319 0.82 BRD4 (0.52) BRD4HTR6
SCHEMBL30812153 0.81 BRD4 (0.50) BRD4HTR6
SCHEMBL30824763 0.81 BRD4 (0.50) BRD4HTR6
SCHEMBL30812273 0.80 BRD4 (0.49) BRD4
SCHEMBL30811952 0.80 BRD4 (0.49) BRD4HTR6
SCHEMBL27392012 0.78 BRD4 (0.51) BRD4HTR6

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-2024054955-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 — — WO disclosed
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