SCHEMBL25870811

SCHEMBL25870811

N#Cc1ccccc1N(c1ccccc1)c1ccc(C=C2C(=O)c3cc4ccccc4cc3C2=O)[se]1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
USP8 P40818 1/20 0.31
USP7 Q93009 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
SCHEMBL25870775 0.91 USP8 (0.33) USP8USP7
SCHEMBL17765710 0.84 SIGMAR1 (0.31)
SCHEMBL25870819 0.82 CA1 (0.34) CA1CA2
SCHEMBL25870820 0.81 CA1 (0.34) CA1CA2
SCHEMBL25870810 0.81 MAOB (0.32) CA1CA2
SCHEMBL17765731 0.78
SCHEMBL25870828 0.78 MAPT (0.32)
SCHEMBL25870824 0.77
SCHEMBL18913112 0.77 KMT2A (0.36) CA1CA2USP8USP7
SCHEMBL25870785 0.77 ACLY (0.32)

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
US-11711930-B2 2023-07-25 US disclosed