SCHEMBL28659172

SCHEMBL28659172

OB(O)Oc1ccc(-c2ccccc2)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.42
IDO1 P14902 1/20 0.37
BACE1 P56817 1/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
MPI P34949 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 1/20 0.35
RCE1 Q9Y256 1/20 0.35
BCL2L1 Q07817 1/20 0.34
HSD17B10 Q99714 1/20 0.34
BRD4 O60885 1/20 0.34
ACACA Q13085 1/20 0.33
HTR6 P50406 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL31104714 0.86 ACHE (0.33) CYP2D6IDO1KDM4EMAPTESR2
SCHEMBL30761764 0.83 CYP2D6 (0.32) CYP2D6ALOX5ALDH1A1HPGDKDM4E
SCHEMBL1244555 0.81 ERN1 (0.45) CYP2D6ALOX5KDM4EMAPTCA1
SCHEMBL31497307 0.78 ALDH1A1 (0.37) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL960732 0.78 TDP1 (0.44) BACE1ALDH1A1HPGDKDM4ERAB9A
SCHEMBL30725510 0.78 TDP1 (0.44) BACE1ALDH1A1HPGDKDM4ERAB9A
SCHEMBL28545665 0.77 CYP2D6 (0.42) CYP2D6IDO1BACE1MEN1MAPT
SCHEMBL30968172 0.77 GPR84 (0.35) CYP2D6BACE1ALOX5ALDH1A1HPGD
SCHEMBL30103879 0.76 IDO1 (0.53) IDO1ALDH1A1HPGDMAPTKMT2A
SCHEMBL1208501 0.76 CRHBP (0.46) ALDH1A1HPGDKDM4EMEN1MAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112106216-B Organic light emitting device 株式会社LG化学 2024-05-31 CN disclosed
CN-113861118-B Condensed ring compound and organic electroluminescent device thereof 湖北尚赛光电材料有限公司 2023-11-03 CN disclosed
CN-111213251-B organic light emitting diode 株式会社LG化学 2023-09-29 CN disclosed
CN-113816909-B Organic electroluminescent material containing phenanthrene structure and device thereof 武汉尚赛光电科技有限公司 2023-07-11 CN disclosed
CN-113173935-B Compound and application thereof 武汉市晟承宇科技有限公司 2023-07-07 CN disclosed
CN-116283811-A Condensed ring compound and organic electroluminescent device thereof 湖北尚赛光电材料有限公司 2023-06-23 CN disclosed
CN-113651807-A Compound and application thereof 北京鼎材科技有限公司 2021-11-16 CN disclosed