SCHEMBL31380309

SCHEMBL31380309

NC1CCCc2ccc(Cc3ncc(Br)c4ccccc34)nc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 1/20 0.32
PLAU P00749 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL31380312 0.76 MBOAT4 (0.33) CXCR4IRAK4
SCHEMBL4245388 0.76 HRH4 (0.37) IRAK4
SCHEMBL31380415 0.75 BACE1 (0.40) IRAK4
SCHEMBL31380346 0.74 IRAK4 (0.35) CXCR4IRAK4
SCHEMBL31380323 0.71 LTA4H (0.37) IRAK4
SCHEMBL27602385 0.71 NQO1 (0.34) IRAK4
SCHEMBL4073537 0.70 ACHE (0.35) CXCR4IRAK4
SCHEMBL31380354 0.69 CYP11B1 (0.38) CXCR4IRAK4
SCHEMBL31380381 0.68 IRAK4 (0.35) IRAK4
SCHEMBL31380373 0.68 KDM1A (0.33)

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
CN-119707931-A Intermediate and synthesis method of 1- (1-oxo-1, 2-dihydro-phthalazin-6-yl) cycloalkyl-1-carboxamide derivatives as MTA synergistic inhibitors of PRMT5 百济神州(北京)生物科技有限公司 2025-03-28 CN disclosed