SCHEMBL9669339

SCHEMBL9669339

CN1Cc2c(C=O)ncn2-c2cccc(Cl)c2C1=O

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 3/20 0.62
GABRB3 P28472 3/20 0.62
GABRA5 P31644 3/20 0.62
GABRA1 P14867 2/20 0.62
GABRA3 P34903 2/20 0.62
GABRA2 P47869 2/20 0.62
GABRA6 Q16445 2/20 0.62
GABRP O00591 1/20 0.62
GABRD O14764 1/20 0.62
GABRB1 P18505 1/20 0.62
GRM5 P41594 1/20 0.62
GABRB2 P47870 1/20 0.62
GABRA4 P48169 1/20 0.62
GABRE P78334 1/20 0.62
GABRG1 Q8N1C3 1/20 0.62
GABRG3 Q99928 1/20 0.62
GABRQ Q9UN88 1/20 0.62

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
SCHEMBL9669559 0.91 GABRG2 (0.62) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9667990 0.88 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9667977 0.88 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9668417 0.88 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9669887 0.88 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9669881 0.88 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA1GABRA3
Bromide SCHEMBL9669515 0.85 GABRG2 (0.57) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL10625307 0.85 GABRG2 (0.57) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL10962588 0.85 GABRG2 (0.67) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL9669755 0.85 GABRG2 (0.56) GABRG2GABRB3GABRA5GABRA1GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0285837-B1 IMIDAZODIAZEPIN DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1992-07-08 EP disclosed
US-4863920-A SEDATIVES, TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1989-09-05 US disclosed
EP-0285837-A1 Imidazodiazepin derivatives F. HOFFMANN-LA ROCHE AG (CH) 1988-10-12 EP disclosed
US-4775671-A ANXIOLYTIC AGENTS, ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1988-10-04 US disclosed
EP-0150040-A2 Imidazodiazepine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1985-07-31 EP disclosed