SCHEMBL20328977

SCHEMBL20328977

C=C/C=C\c1c(C)c2c3c(ccc2n1-c1ccccc1)[nH]c1ccccc13

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 2/20 0.34
▸ PDE7B Q9NP56 2/20 0.34
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GABRA2 P47869 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ GABRA4 P48169 1/20 0.33
▸ GABRE P78334 1/20 0.33
▸ GABRA6 Q16445 1/20 0.33
▸ GABRG1 Q8N1C3 1/20 0.33
▸ GABRG3 Q99928 1/20 0.33
▸ GABRQ Q9UN88 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 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
SCHEMBL20885270 0.79 KDM4E (0.30) L3MBTL1KDM4E
SCHEMBL18436869 0.76 KDM4E (0.46) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL13466230 0.76 PDE7A (0.47) PDE7APDE7BGABRPGABRDGABRA1
SCHEMBL22960853 0.75 MAPK1 (0.33) MEN1KMT2AL3MBTL1KDM4EHTT
SCHEMBL23309129 0.75 GABRP (0.32) PDE7APDE7BGABRPGABRDGABRA1
SCHEMBL23618398 0.74 LMNA (0.35) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL24434227 0.73 KDM4E (0.33) L3MBTL1KDM4E
SCHEMBL23505154 0.73 MAPT (0.35) PDE7APDE7BMEN1KMT2ALMNA
SCHEMBL17254120 0.72 L3MBTL1 (0.52) PDE7APDE7BGABRPGABRDGABRA1
SCHEMBL29642039 0.72 L3MBTL1 (0.52) PDE7APDE7BGABRPGABRDGABRA1

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-20180182970-A1 COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-06-28 — — US disclosed
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