SCHEMBL23219209

SCHEMBL23219209

CCCC(C(=O)O)c1ccccc1OCc1nn(C(C)C)c2ccc(-c3cccc(CN)c3)cc12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CFD P00746 8/20 0.40
PLAU P00749 8/20 0.40
PLG P00747 5/20 0.40
TPSB2 P20231 4/20 0.40
F11 P03951 3/20 0.40
KLKB1 P03952 1/20 0.40
F7 P08709 1/20 0.40
ADAMTS4 O75173 1/20 0.34
ICMT O60725 1/20 0.34
PLAT P00750 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
CMKLR1 Q99788 1/20 0.33
SSTR5 P35346 1/20 0.33

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
SCHEMBL29853066 1.00 CFD (0.40) CFDPLAUPLGTPSB2F11
SCHEMBL23219028 0.95 CFD (0.39) CFDPLAUPLGTPSB2F11
SCHEMBL29853069 0.95 CFD (0.39) CFDPLAUPLGTPSB2F11
SCHEMBL29852818 0.92 CFD (0.43) CFDPLAUPLGTPSB2F11
SCHEMBL23219193 0.92 CFD (0.43) CFDPLAUPLGTPSB2F11
SCHEMBL23219138 0.88 CFD (0.42) CFDPLAUPLGTPSB2F11
SCHEMBL29852616 0.88 CFD (0.42) CFDPLAUPLGTPSB2F11
SCHEMBL23228977 0.87 CFD (0.37) CFDPLAUPLGTPSB2F11
SCHEMBL23229178 0.87 CFD (0.37) CFDPLAUPLGTPSB2F11
SCHEMBL23219231 0.84 PLG (0.46) CFDPLAUPLGTPSB2F11

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
CN-114502168-A Oral complement factor D inhibitors 拜奥克里斯特制药公司 2022-05-13 CN disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed