SCHEMBL30868629

SCHEMBL30868629

c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2ccc3ccc4cccnc4c3n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.44
CCR8 P51685 5/20 0.44
CCR5 P51681 3/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GMNN O75496 1/20 0.44
TP53 P04637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MMP2 P08253 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
MMP9 P14780 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
MMP8 P22894 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL16303787 1.00 CCR1 (0.44) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18904496 1.00 CCR1 (0.44) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18904471 0.99 CCR1 (0.43) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18904454 0.97 CCR1 (0.42) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL17789420 0.96 CCR1 (0.41) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18904477 0.94 CCR1 (0.44) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18904459 0.94 CCR1 (0.44) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL31282562 0.94 CCR1 (0.50) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL18886531 0.94 CCR1 (0.50) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL17231471 0.94 CCR1 (0.50) CCR1CCR8CCR5LMNAKDM4E

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-2024052786-A1 LIGHT-EMITTING DEVICE AND DISPLAY APPARATUS 株式会社半導体エネルギー研究所 2024-03-14 WO disclosed