SCHEMBL31380405

SCHEMBL31380405

NC1CCc2ccc(Cc3ccc(-c4c(F)cccc4F)cn3)nc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.36
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ABL1 P00519 2/20 0.32
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL31380372 0.87 IRAK4 (0.33) IRAK4
SCHEMBL31380346 0.77 IRAK4 (0.35) IRAK4
SCHEMBL31380312 0.70 MBOAT4 (0.33) IRAK4
SCHEMBL31380354 0.70 CYP11B1 (0.38) IRAK4CYP11B1CYP11B2ABL1
SCHEMBL31380397 0.69 CYP11B2 (0.36) IRAK4CYP11B2ABL1ALOX5AP
SCHEMBL31380316 0.69 HDAC1 (0.43)
SCHEMBL17680262 0.68 ALOX5AP (0.41) ALOX5APFEN1
SCHEMBL31380323 0.67 LTA4H (0.37) IRAK4
SCHEMBL31380313 0.64 HDAC1 (0.41) ABL1
SCHEMBL30983305 0.64 CHEK1 (0.42) ABL1ALOX5APFEN1

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