SCHEMBL30765899

SCHEMBL30765899

C[C@H](Nc1cnc(N2CCn3c(nnc3C(F)(F)F)C2)n(CC(=O)OC(C)(C)C)c1=O)c1ccc2oc3ccccc3c2c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP8B1 Q9UNU6 13/20 0.34
BTK Q06187 1/20 0.34
DPP4 P27487 2/20 0.32
BACE1 P56817 1/20 0.32
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
PARP3 Q9Y6F1 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PIK3CA P42336 1/20 0.31

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
SCHEMBL30765691 0.92 CYP8B1 (0.35) CYP8B1BTKDPP4PARP1PARP2
SCHEMBL31558512 0.91 BTK (0.35) CYP8B1BTKDPP4PARP1PARP2
SCHEMBL30765505 0.90 GAA (0.34) CYP8B1BTKDPP4HDAC6
SCHEMBL30766002 0.86 USP2 (0.37) BACE1PIK3CA
SCHEMBL31558461 0.84 BACE1 (0.43) BACE1
SCHEMBL30766121 0.82 MAPK1 (0.34) CYP8B1BTKHDAC6
SCHEMBL30766008 0.80 BACE1 (0.43) BACE1PIK3CA
SCHEMBL30765755 0.79 BACE1 (0.37) BACE1
SCHEMBL30765991 0.79 ELANE (0.42)
SCHEMBL30765957 0.79 ALDH1A1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4568666-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Alexion Pharmaceuticals, Inc. (US) 2025-06-18 EP disclosed
WO-2024035686-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2024-02-15 WO disclosed