SCHEMBL25080255

SCHEMBL25080255

CCC(=O)NN(C)C(Br)OC

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL20052604 0.69
SCHEMBL629814 0.67
SCHEMBL25700435 0.65
SCHEMBL11545282 0.65 CYP2C9 (0.41) CYP2C9KMT2AMEN1
SCHEMBL4857193 0.64 KDM4E (0.33) CYP2C9
SCHEMBL11224794 0.64 MEN1 (0.43) CYP2C9KMT2AMEN1
SCHEMBL11548388 0.63 MEN1 (0.39) CYP2C9KMT2AMEN1
SCHEMBL8675386 0.62 KMT2A (0.42) CYP2C9KMT2AMEN1POLB
SCHEMBL28398545 0.61 CYP2C9 (0.38) CYP2C9KMT2AMEN1POLB
SCHEMBL23295106 0.61 CYP2C9 (0.34) CYP2C9KMT2AMEN1POLB

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-2023019430-A1 COMPOUNDS AS IMMUNOMODULATORS OF PD-L1 INTERACTIONS ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-02-23 WO disclosed