SCHEMBL24657648

SCHEMBL24657648

N=C(/N=C(\N)c1cc(-c2ccccc2)cc2oc3ccccc3c12)c1cccc(-c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
HTR2B P41595 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
DHODH Q02127 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KMO O15229 1/20 0.32
MAPT P10636 1/20 0.32
PTPN1 P18031 1/20 0.32
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
F2 P00734 2/20 0.31
PLG P00747 2/20 0.31
F10 P00742 1/20 0.31
PLAU P00749 1/20 0.31
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
HCRTR1 O43613 1/20 0.31

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
SCHEMBL23822246 0.88 F2 (0.38) PRSS1HTR2BALDH1A1GLAL3MBTL1
SCHEMBL24655499 0.85 PRSS1 (0.40) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL25008980 0.83 WDR5 (0.40) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL24907678 0.83 ALDH1A1 (0.43) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL21191645 0.83 PRSS1 (0.43) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL25506602 0.81 HTR2B (0.36) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL27466516 0.81 PRSS1 (0.44) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL25654459 0.81 HTR2B (0.36) PRSS1PRSS2PRSS3HTR2BALDH1A1
SCHEMBL25654493 0.81 PRSS1 (0.38) PRSS1PRSS2PRSS3HTR2BPLA2G2A
SCHEMBL24655489 0.80 PLAU (0.36) PRSS1PRSS2PRSS3HTR2BALDH1A1

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-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 WO disclosed