SCHEMBL30968172

SCHEMBL30968172

OB(O)Oc1c2ccccc2c(-c2ccc(-c3ccccc3)c3ccccc23)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.35
RAB9A P51151 1/20 0.33
RCE1 Q9Y256 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
MPI P34949 1/20 0.33
ALOX5 P09917 1/20 0.32
BACE1 P56817 1/20 0.32
PDE4B Q07343 3/20 0.32
PDE4A P27815 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
BRD4 O60885 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL5555759 0.90 ALDH1A1 (0.35) GPR84RAB9ARCE1ALDH1A1HPGD
SCHEMBL2447870 0.85 ACHE (0.38) GPR84ALDH1A1HPGDKDM4EKMT2A
SCHEMBL5556127 0.82 MGLL (0.41) ALDH1A1HPGDKDM4EMAPTPDE4B
SCHEMBL1207137 0.80 CRHBP (0.41) ALDH1A1HPGDKDM4EKMT2AMAPT
SCHEMBL30937737 0.79 MGLL (0.35) GPR84ALDH1A1PDE4BPDE4APDE4C
SCHEMBL5555756 0.79 GSK3B (0.39) GPR84KDM4EMEN1KMT2AHDAC8
SCHEMBL30542925 0.79 GSK3B (0.39) GPR84KDM4EMEN1KMT2AHDAC8
SCHEMBL5858791 0.79 ESR1 (0.36) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL31104714 0.78 ACHE (0.33) GPR84KDM4EMAPTCYP2D6ESR2
SCHEMBL31020815 0.77 GPR84 (0.38) GPR84RAB9ARCE1ALDH1A1HPGD

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
CN-118344392-A Light-emitting element and condensed polycyclic compound for use in the same 三星显示有限公司 2024-07-16 CN disclosed