SCHEMBL27717804

SCHEMBL27717804

c1cc2ccc3ccc(-c4cccc5c4[nH]c4ccccc45)c4ccc(c1)c2c34

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.57
BCHE P06276 1/20 0.48
GABRP O00591 1/20 0.47
GABRD O14764 1/20 0.47
GABRA1 P14867 1/20 0.47
GABRB1 P18505 1/20 0.47
GABRG2 P18507 1/20 0.47
GABRB3 P28472 1/20 0.47
GABRA5 P31644 1/20 0.47
GABRA3 P34903 1/20 0.47
GABRA2 P47869 1/20 0.47
GABRB2 P47870 1/20 0.47
GABRA4 P48169 1/20 0.47
GABRE P78334 1/20 0.47
GABRA6 Q16445 1/20 0.47
GABRG1 Q8N1C3 1/20 0.47
GABRG3 Q99928 1/20 0.47
GABRQ Q9UN88 1/20 0.47
PARP14 Q460N5 12/20 0.46
CDK4 P11802 1/20 0.45

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
SCHEMBL29986732 0.85 KIF11 (0.68) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL147411 0.83 BCHE (0.64) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL29986487 0.83 BCHE (0.64) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL31328774 0.83 KIF11 (0.64) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL208113 0.81 KIF11 (0.63) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL29733506 0.81 KIF11 (0.63) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL6315009 0.80 KIF11 (0.46) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL28592283 0.80 KIF11 (0.70) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL191654 0.79 KIF11 (0.61) KIF11BCHEGABRPGABRDGABRA1
SCHEMBL51674 0.79 KIF11 (0.61) KIF11BCHEGABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120202202-A Compound and material for organic electroluminescent element, and organic electroluminescent element 日铁化学材料株式会社 2025-06-24 CN disclosed
WO-2023153482-A1 MATERIAL FOR METAL PATTERNING, HETEROCYCLIC COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENT DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2023-08-17 WO disclosed
CN-101139317-B Organic semiconductor material containing carbazole unit and synthesis UNIV NANJING POSTS & TELECOMM 2011-09-07 CN disclosed
CN-101139317-A Organic semiconductor material containing carbazole unit and synthesis UNIV NANJING POSTS & TELECOMM (CN) 2008-03-12 CN disclosed