SCHEMBL25869442

SCHEMBL25869442

c1ccc(-c2cccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cc5ccccc5c5c4oc4ccccc45)cc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
ALOX5 P09917 1/20 0.34
GPR84 Q9NQS5 2/20 0.34
RAB9A P51151 2/20 0.33
SLC6A9 P48067 1/20 0.33
CDC14B O60729 1/20 0.33
CDC14A Q9UNH5 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAOB P27338 1/20 0.33
CYP1A1 P04798 2/20 0.33
CYP1A2 P05177 2/20 0.33
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
FYN P06241 1/20 0.33

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
SCHEMBL25869565 0.96 GPR84 (0.36) ALOX5GPR84RAB9ACDC14BCDC14A
SCHEMBL25869341 0.96 GPR84 (0.36) ALOX5GPR84RAB9ACDC14BCDC14A
SCHEMBL19961050 0.93 ALOX5 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24886879 0.93 CA12 (0.38) CA12CA1CA2CA9MCL1
SCHEMBL19961088 0.93 ALOX5 (0.39) CA12CA1CA2CA9ALOX5
SCHEMBL25869201 0.92 GPR84 (0.34) ALOX5GPR84RAB9ACDC14BCDC14A
SCHEMBL25869356 0.92 PLA2G2A (0.39) ALOX5GPR84RAB9ACDC14BCDC14A
SCHEMBL19961076 0.92 ALOX5 (0.37) CA12CA1CA2CA9ALOX5
SCHEMBL25869436 0.92 CA12 (0.37) CA12CA1CA2CA9MCL1
SCHEMBL25869758 0.91 GPR84 (0.34) ALOX5GPR84RAB9ACDC14BCDC14A

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed