SCHEMBL17345674

SCHEMBL17345674

N=C(/C=C(\N)c1cccc(-c2ccccc2)c1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 4/20 0.62
▸ PRSS2 P07478 3/20 0.62
▸ PRSS3 P35030 3/20 0.62
▸ KMO O15229 1/20 0.46
▸ WDR5 P61964 1/20 0.44
▸ DHODH Q02127 2/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ F2 P00734 2/20 0.41
▸ F10 P00742 2/20 0.41
▸ F12 P00748 1/20 0.41
▸ F7 P08709 1/20 0.41
▸ F3 P13726 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ BLM P54132 1/20 0.39
▸ ERCC5 P28715 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ PLG P00747 1/20 0.38
▸ PLAU P00749 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ C1S P09871 1/20 0.38

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
SCHEMBL22373684 0.97 PRSS1 (0.62) PRSS1PRSS2PRSS3KMOWDR5
SCHEMBL17454811 0.93 PRSS1 (0.62) PRSS1PRSS2PRSS3KMOWDR5
SCHEMBL16900978 0.86 WDR5 (0.57) PRSS1PRSS2PRSS3WDR5F2
SCHEMBL15034688 0.86 WDR5 (0.57) PRSS1PRSS2PRSS3WDR5F2
SCHEMBL16615027 0.84 WDR5 (0.59) PRSS1PRSS2PRSS3WDR5F2
SCHEMBL12282269 0.83 F2 (0.52) PRSS1PRSS2PRSS3WDR5F2
SCHEMBL17117712 0.80 PRSS1 (0.39) PRSS1PRSS2PRSS3WDR5F2
SCHEMBL14676446 0.77 PRSS1 (1.00) PRSS1PRSS2PRSS3KMOWDR5
SCHEMBL17449533 0.77 PRSS1 (0.59) PRSS1PRSS2PRSS3KMOWDR5
SCHEMBL16615090 0.76 PRSS1 (0.58) PRSS1PRSS2PRSS3KMOWDR5

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-2015190789-A1 AN ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-12-17 — — WO disclosed
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