SCHEMBL25862198

SCHEMBL25862198

N=C(/C=C\C(=N)c1cccc(-c2c(-c3ccccc3)ccc(-c3ccccc3)c2-c2cccc(C(=N)/C=C\Cc3ccccc3)c2)c1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GPR52 Q9Y2T5 4/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ MAOB P27338 1/20 0.36
▸ PRSS1 P07477 3/20 0.36
▸ PRSS2 P07478 3/20 0.36
▸ PRSS3 P35030 3/20 0.36
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ ARG2 P78540 1/20 0.33
▸ PTGER1 P34995 2/20 0.32
▸ HTR1A P08908 1/20 0.31
▸ GPR68 Q15743 1/20 0.31
▸ PLA2G2A P14555 1/20 0.31
▸ FOLH1 Q04609 1/20 0.31
▸ KMO O15229 1/20 0.30
▸ CFD P00746 1/20 0.30
▸ KCNA3 P22001 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
SCHEMBL25861903 0.89 PRSS1 (0.43) GPR52CNR2PRSS1PRSS2PRSS3
SCHEMBL25862047 0.80 PRSS1 (0.43) GPR52CNR2PRSS1PRSS2PRSS3
SCHEMBL25861808 0.77 WDR5 (0.41) PRSS1PRSS2PRSS3
SCHEMBL24689800 0.74 PRSS1 (0.46) GPR52PRSS1PRSS2PRSS3PTGER1
SCHEMBL25861813 0.72 WDR5 (0.40) PRSS1PRSS2PRSS3
SCHEMBL25861647 0.71 ADORA2A (0.39) PRSS1
SCHEMBL25862046 0.70 MMP9 (0.38) PRSS1PRSS2PRSS3
SCHEMBL25861649 0.70 WDR5 (0.39) PRSS1PRSS2PRSS3
SCHEMBL27403657 0.68 HSD17B1 (0.46) CNR2PRSS1PRSS2PRSS3
SCHEMBL25861653 0.66 ADORA3 (0.40) PRSS1PRSS2PRSS3

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-2023136457-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-20 — — WO disclosed
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