SCHEMBL9715787

SCHEMBL9715787

c1ccc(Cc2cn(-c3ccccc3)c(-c3ccccc3)n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 3/20 0.47
GABRB2 P47870 3/20 0.47
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 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
SCHEMBL755602 0.92 GABRA2 (0.40) GABRA2GABRB2
SCHEMBL14513797 0.81 PTGS2 (0.52) GABRA2GABRB2
SCHEMBL28237437 0.79 GABRA2 (0.52) GABRA2GABRB2
SCHEMBL10332224 0.77 GABRA1 (0.46) GABRB2NR1H2NR1H3
SCHEMBL5594689 0.76 PTGS2 (0.72)
SCHEMBL5594686 0.76 PTGS2 (0.60)
SCHEMBL5594568 0.76 PTGS2 (0.72)
SCHEMBL28168647 0.74 GABRA2 (0.45) GABRA2GABRB2
SCHEMBL15459645 0.73 GABRA2 (0.47) GABRA2GABRB2NR1H2NR1H3
SCHEMBL82549 0.73 PTGS1 (0.62) GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101878552-A Organic light-emitting diodes containing carbene transition metal complex emitters and at least one compound selected from disilylcarbazoles, disilyldibenzofurans, disilyldibenzothiophenes, disilyldibenzophospholes, disilyldibenzothiophene s-oxides a BASF SE 2010-11-03 CN disclosed
CN-101460515-A Heteroleptic transition metal-carbene complexes and their use in organic light-emitting diodes (OLEDs) BASF SE (DE) 2009-06-17 CN disclosed
WO-1992016681-A2 BINDER COATED DISCONTINUOUS FIBERS WITH ADHERED PARTICULATE MATERIALS WEYERHAEUSER CO (US) 1992-10-01 WO disclosed