SCHEMBL7306805

SCHEMBL7306805

CCc1ccc2c(c1)C(c1ccccc1F)=NCC(=O)N2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 9/20 0.69
GABRA5 P31644 9/20 0.69
GABRA3 P34903 9/20 0.69
GABRA2 P47869 8/20 0.69
GABRB2 P47870 6/20 0.69
LMNA P02545 2/20 0.69
GABRG2 P18507 7/20 0.52
GABRB3 P28472 7/20 0.52
GABRP O00591 3/20 0.52
GABRD O14764 3/20 0.52
GABRB1 P18505 3/20 0.52
GABRA4 P48169 3/20 0.52
GABRE P78334 3/20 0.52
GABRA6 Q16445 3/20 0.52
GABRG1 Q8N1C3 3/20 0.52
GABRG3 Q99928 3/20 0.52
GABRQ Q9UN88 3/20 0.52
CHRM1 P11229 2/20 0.50
PDE4D Q08499 2/20 0.47
CNR1 P21554 1/20 0.47

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
SCHEMBL8547651 0.85 GABRA1 (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL2615274 0.84 GABRA1 (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL2615273 0.84 GABRA1 (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL31696096 0.81 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL638723 0.81 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRB2
N-Desalkyl-2-Oxoquazepam SCHEMBL30730010 0.81 LMNA (1.00) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL15435606 0.81 GABRA1 (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
N-Desalkyl-2-Oxoquazepam SCHEMBL30529978 0.81 LMNA (1.00) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL7318175 0.81 GABRA1 (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
N-Desalkyl-2-Oxoquazepam SCHEMBL5177297 0.81 LMNA (1.00) GABRA1GABRA5GABRA3GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4440685-A MUSCLE RELAXANTS, SEDATIVES, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1984-04-03 US disclosed
US-4425272-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1984-01-10 US disclosed
US-4401597-A INTERMEDIATES FOR ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVE AND ANXIOLYTICS HOFFMANN-LA ROCHE INC. (US) 1983-08-30 US disclosed
US-4390471-A INTERMEDIATES FOR IMIDOBENZODIAZEPINE AND ANALOGS HOFFMANN-LA ROCHE INC. (US) 1983-06-28 US disclosed
US-4377523-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1983-03-22 US disclosed
US-4376075-A REACTION OF AN AMINODERIVATIVE THEREOF WITH AN ALDEHYDE HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4376074-A ANTICONVULSANTS, MUSCLE RELAXANTS AND SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4371468-A ANTICONVULSANTS, MUSCLE RELAXANTS, AND SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-02-01 US disclosed
US-4368157-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4368159-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4368158-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4349476-A IMIDAZO/1,5-A//1,4) BENZO-, THIENO-, OR PYRAZOLODIAZEPINES FROM DERIVATIVES OF BENZO-, THIENO- OR PYRAZOLODIAZEPINE HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4349477-A IMIPAZO/1,5-A//1,4/BENZO-, THIENO- OR PYRAZOLODIAZEPINES FROM 2-DIMORPHOLINOPHOSPHONATES OF BENZO-, THIENO- OR PYRAZOLODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4349475-A IMIDAZO/1,5-A//1,4/BENZO-, THIENO-, OR PYRAZOLODIAZEPINES FROM DERIVATIVES OF BENZOTHIENO-OR PYRAZOLODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4347365-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4347364-A INTERMEDIATES THEREFOR HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4307237-A ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1981-12-22 US disclosed
US-4280957-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1981-07-28 US disclosed