SCHEMBL16067879

SCHEMBL16067879

c1ccc2c(-c3ccc4[nH]c5c6ccccc6c6ccccc6c5c4c3)c3ccccc3c(-c3ccc4c5ccccc5c5ccccc5c4c3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRP O00591 1/20 0.49
▸ GABRD O14764 1/20 0.49
▸ GABRA1 P14867 1/20 0.49
▸ GABRB1 P18505 1/20 0.49
▸ GABRG2 P18507 1/20 0.49
▸ GABRB3 P28472 1/20 0.49
▸ GABRA5 P31644 1/20 0.49
▸ GABRA3 P34903 1/20 0.49
▸ GABRA2 P47869 1/20 0.49
▸ GABRB2 P47870 1/20 0.49
▸ GABRA4 P48169 1/20 0.49
▸ GABRE P78334 1/20 0.49
▸ GABRA6 Q16445 1/20 0.49
▸ GABRG1 Q8N1C3 1/20 0.49
▸ GABRG3 Q99928 1/20 0.49
▸ GABRQ Q9UN88 1/20 0.49
▸ CDK5 Q00535 3/20 0.46
▸ CDK5R1 Q15078 3/20 0.46
▸ GSK3B P49841 3/20 0.46
▸ GSK3A P49840 2/20 0.46

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
SCHEMBL16067675 0.97 CDK5 (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16068043 0.92 GSK3A (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16068056 0.92 GSK3A (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16067692 0.91 GABRP (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16067762 0.90 GABRP (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16068049 0.89 CDK4 (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16067809 0.89 CDK4 (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16068094 0.89 KIF11 (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16067784 0.88 CDK4 (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16067804 0.88 CDK4 (0.44) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2924029-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME Idemitsu Kosan Co., Ltd (JP) 2015-09-30 — — EP disclosed
WO-2014141725-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME 出光興産株式会社 (JP) 2014-09-18 — — WO disclosed
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