SCHEMBL29815212

SCHEMBL29815212

c1ccc2c(c1)Nc1ccccc1C21c2ccccc2Nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
ADORA3 P0DMS8 2/20 0.47
CHRM2 P08172 1/20 0.47
KCNH2 Q12809 1/20 0.47
PDK2 Q15119 1/20 0.46
PDK4 Q16654 1/20 0.46
GAA P10253 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
NOX1 Q9Y5S8 2/20 0.43
ALOX5 P09917 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
MAOA P21397 1/20 0.43

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
SCHEMBL9332219 1.00 LMNA (0.54) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL29416297 0.89 LMNA (0.47) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL18314522 0.89 LMNA (0.47) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL22481656 0.87 PDK2 (0.54) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL22481699 0.85 LMNA (0.44) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL29373003 0.84 LMNA (0.69) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL2453350 0.84 LMNA (0.69) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL22044254 0.83 HTR2A (0.44) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL16389417 0.83 NOX1 (0.60) LMNAADORA3CHRM2KCNH2PDK2
SCHEMBL15030650 0.83 ALOX5 (0.60) LMNAADORA3CHRM2KCNH2PDK2

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-118702727-A Acridine derivative hole transport material with phosphoric acid anchoring function, preparation method thereof, perovskite solar cell and preparation method thereof 广东工业大学 2024-09-27 CN claimed
CN-118373847-A Spiro self-assembled single-molecule hole transport material and preparation method and application thereof 华北电力大学 2024-07-23 CN claimed
CN-118005665-A Boron-nitrogen compound and preparation method and application thereof 华南理工大学 2024-05-10 CN claimed
CN-118702727-A Acridine derivative hole transport material with phosphoric acid anchoring function, preparation method thereof, perovskite solar cell and preparation method thereof 广东工业大学 2024-09-27 CN disclosed
CN-118373847-A Spiro self-assembled single-molecule hole transport material and preparation method and application thereof 华北电力大学 2024-07-23 CN disclosed
CN-118005665-A Boron-nitrogen compound and preparation method and application thereof 华南理工大学 2024-05-10 CN disclosed
CN-114790170-A Light-emitting element and nitrogen-containing compound used for the same 三星显示有限公司 2022-07-26 CN disclosed