SCHEMBL22916636

SCHEMBL22916636

N=C(/N=C(\N)c1cccc2oc3cc(Cl)c(-c4ccc(-c5ccccc5)cc4)cc3c12)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 2/20 0.35
PRKAG1 P54619 2/20 0.35
PRKAA2 P54646 2/20 0.35
PRKAA1 Q13131 2/20 0.35
PRKAG3 Q9UGI9 2/20 0.35
PRKAG2 Q9UGJ0 2/20 0.35
PRKAB1 Q9Y478 2/20 0.35
PRSS1 P07477 3/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
TTR P02766 1/20 0.31
F2 P00734 2/20 0.31
F10 P00742 2/20 0.31
PLAU P00749 2/20 0.31
PLAT P00750 2/20 0.31
AHR P35869 1/20 0.31
PLG P00747 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
WDR5 P61964 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
SCHEMBL22916346 0.98 PRKAB2 (0.33) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL24655499 0.85 PRSS1 (0.40) PRSS1PRSS2PRSS3PLAUPLG
SCHEMBL23820566 0.83 AHR (0.38) TTRF2AHRWDR5
SCHEMBL25654493 0.83 PRSS1 (0.38) PRSS1PRSS2PRSS3TTRF2
SCHEMBL25008980 0.81 WDR5 (0.40) PRSS1PRSS2PRSS3TTRWDR5
SCHEMBL24315343 0.81 AHR (0.43) TTRAHRMAPT
SCHEMBL22992123 0.80 MAPT (0.38) PRSS1PRSS2PRSS3F2PLAU
SCHEMBL24657618 0.80 AHR (0.38) TTRAHRWDR5GAAMAPT
SCHEMBL25654459 0.79 HTR2B (0.36) PRSS1PRSS2PRSS3TTRF2
SCHEMBL24656660 0.79 F9 (0.35) PRSS1PRSS2PRSS3F2F10

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-2021015603-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-01-28 WO disclosed