SCHEMBL23218806

SCHEMBL23218806

COC(=O)c1cccc(OCc2nn(C(C)C)c3ccc(-c4cccc(CN)c4)cc23)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.46
MRGPRX4 Q96LA9 2/20 0.42
CFD P00746 1/20 0.40
VDR P11473 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.39
NR4A2 P43354 1/20 0.39
NEK1 Q96PY6 1/20 0.39
NR1H4 Q96RI1 3/20 0.39
DHFR P00374 1/20 0.38
ADAMTS4 O75173 1/20 0.38
MMP13 P45452 1/20 0.38
PLAU P00749 1/20 0.37
F2 P00734 1/20 0.37
SSTR5 P35346 1/20 0.37
MGLL Q99685 1/20 0.37

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
SCHEMBL29852680 1.00 LOXL2 (0.46) LOXL2MRGPRX4CFDVDRCYSLTR1
SCHEMBL23219181 0.91 NR4A2 (0.50) LOXL2MRGPRX4CFDNR4A2NR1H4
SCHEMBL29591762 0.91 NR4A2 (0.50) LOXL2MRGPRX4CFDNR4A2NR1H4
SCHEMBL23218903 0.88 CFD (0.42) CFDVDRADAMTS4PLAUSSTR5
SCHEMBL23218710 0.86 CFD (0.50) CFDNR4A2NR1H4PLAUSSTR5
SCHEMBL29853032 0.83 ELANE (0.50) MRGPRX4VDRCYSLTR1NR1H4
SCHEMBL29593262 0.83 ELANE (0.50) MRGPRX4VDRCYSLTR1NR1H4
SCHEMBL23218589 0.83 ELANE (0.50) MRGPRX4VDRCYSLTR1NR1H4
SCHEMBL23219231 0.79 PLG (0.46) CFDVDRPLAUF2
SCHEMBL23219055 0.78 CFD (0.45) CFDPLAU

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4041238-A1 ORAL COMPLEMENT FACTOR D INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-08-17 EP disclosed
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
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed