SCHEMBL9264342

SCHEMBL9264342

Clc1cccc2c1-c1ncnn1Cc1c(-c3noc(C4CC4)n3)ncn1-2

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 1/20 0.58
GABRB3 P28472 1/20 0.58
GABRA5 P31644 1/20 0.58
GABRA1 P14867 4/20 0.55
GABRB2 P47870 4/20 0.55
GABRA6 Q16445 2/20 0.55
GABRA3 P34903 2/20 0.51

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
SCHEMBL9262828 0.85 GABRA1 (0.61) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL9268572 0.84 GABRG2 (0.59) GABRG2GABRB3GABRA5GABRA1GABRA6
SCHEMBL9263501 0.82 GABRG2 (0.65) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL10656205 0.81 GABRA1 (0.73) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL9260177 0.80 GABRA1 (0.52) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL9259583 0.79 GABRG2 (0.64) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL9259917 0.78 GABRG2 (0.77) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL4592960 0.75 GABRG2 (1.00) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9658410 0.74 GABRA1 (0.62) GABRG2GABRB3GABRA5GABRA1GABRB2
SCHEMBL10672729 0.74 GABRA1 (0.61) GABRG2GABRB3GABRA5GABRA1GABRB2

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
US-5387585-A Treating epilepsy, anxiety, sleep disorders, schizophrnia, senile dementia HOFFMANN-LA ROCHE INC. (US) 1995-02-07 US disclosed
EP-0519307-A2 Tetracyclic Imidazodiazepines F. HOFFMANN-LA ROCHE AG (CH) 1992-12-23 EP disclosed