SCHEMBL23383669

SCHEMBL23383669

N#Cc1ccccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 3/20 0.44
▸ GABRB3 P28472 3/20 0.44
▸ GABRA5 P31644 2/20 0.44
▸ GABRA3 P34903 2/20 0.44
▸ CYP11B1 P15538 2/20 0.44
▸ CYP11B2 P19099 2/20 0.44
▸ TRPA1 O75762 1/20 0.43
▸ ESR2 Q92731 1/20 0.42
▸ GABRA1 P14867 2/20 0.41
▸ GABRA2 P47869 2/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ MEN1 O00255 2/20 0.39

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
SCHEMBL23383856 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23384201 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23383858 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23384207 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23384199 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23384195 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23383903 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23383814 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23384024 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1
SCHEMBL23383898 1.00 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3CYP11B1

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
US-20210151688-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2021-05-20 — — US disclosed
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