SCHEMBL22912384

SCHEMBL22912384

N=C(/N=C(\N)c1ccc2c3ccccc3c3ccccc3c2c1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.41
PLG P00747 3/20 0.41
F10 P00742 1/20 0.39
F12 P00748 1/20 0.39
F7 P08709 1/20 0.39
F3 P13726 1/20 0.39
PKM P14618 1/20 0.39
BLM P54132 1/20 0.38
PRSS1 P07477 5/20 0.37
PRSS2 P07478 3/20 0.37
PRSS3 P35030 3/20 0.37
KMT2A Q03164 2/20 0.37
C1S P09871 1/20 0.37
RECQL P46063 1/20 0.37
NQO2 P16083 1/20 0.37
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 1/20 0.35
WDR5 P61964 1/20 0.35

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
SCHEMBL24972852 0.87 CASP3 (0.47) F2PLGF10F12F7
SCHEMBL21732405 0.83 ALDH1A1 (0.45) F2PLGF10F12F7
SCHEMBL27254640 0.82 HTR2B (0.56) F2PLGKMT2ANPC1GAA
SCHEMBL10252853 0.82 F2 (0.52) F2F10F12F7F3
SCHEMBL19596547 0.80 F2 (0.38) F2PLGF10PRSS1KMT2A
SCHEMBL22912402 0.79 KDM4E (0.46) F2PLGF10F12F7
SCHEMBL24747308 0.79 PRSS1 (0.59) F2PLGF10F12F7
SCHEMBL23735594 0.78 HPRT1 (0.37) F2PLGF10F12F7
SCHEMBL19791258 0.78 PRSS1 (0.62) F2PLGF10F12F7
SCHEMBL22271165 0.77 WDR5 (0.57) F2F10F12F7F3

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
US-20210020852-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2021-01-21 US disclosed