SCHEMBL7323441

SCHEMBL7323441

O=C1CN=C(c2c(F)cccc2F)c2cc(Cl)ccc2N1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.77
GABRA1 P14867 7/20 0.77
GABRA5 P31644 7/20 0.77
GABRA3 P34903 7/20 0.77
GABRA2 P47869 7/20 0.77
GABRB2 P47870 6/20 0.77
GABRG2 P18507 5/20 0.77
GABRB3 P28472 5/20 0.77
GABRP O00591 3/20 0.77
GABRD O14764 3/20 0.77
GABRB1 P18505 3/20 0.77
GABRA4 P48169 3/20 0.77
GABRE P78334 3/20 0.77
GABRA6 Q16445 3/20 0.77
GABRG1 Q8N1C3 3/20 0.77
GABRG3 Q99928 3/20 0.77
GABRQ Q9UN88 3/20 0.77
CNR1 P21554 1/20 0.67
NTSR1 P30989 1/20 0.67
OPRK1 P41145 1/20 0.67

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
N-Desalkyl-2-Oxoquazepam SCHEMBL30730010 0.87 LMNA (1.00) LMNAGABRA1GABRA5GABRA3GABRA2
N-Desalkyl-2-Oxoquazepam SCHEMBL30529978 0.87 LMNA (1.00) LMNAGABRA1GABRA5GABRA3GABRA2
N-Desalkyl-2-Oxoquazepam SCHEMBL5177297 0.87 LMNA (1.00) LMNAGABRA1GABRA5GABRA3GABRA2
SCHEMBL7322840 0.85 CHRM1 (0.77) LMNAGABRA1GABRA5GABRA3GABRA2
SCHEMBL30202071 0.85 GABRA1 (0.77) LMNAGABRA1GABRA5GABRA3GABRA2
SCHEMBL23881586 0.85 GABRA1 (0.56) LMNAGABRA1GABRA5GABRA3GABRA2
SCHEMBL23881487 0.85 GABRA1 (0.77) LMNAGABRA1GABRA5GABRA3GABRA2
Nordazepam SCHEMBL31000330 0.80 PDE4D (1.00) LMNAGABRA1GABRA5GABRA3GABRA2
Nordazepam SCHEMBL29354494 0.80 PDE4D (1.00) LMNAGABRA1GABRA5GABRA3GABRA2
Nordazepam SCHEMBL8090999 0.80 PDE4D (1.00) LMNAGABRA1GABRA5GABRA3GABRA2

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
US-3987052-A SEDATIVES, TRANQUILIZERS, MUSCLE RELAXANTS THE UPJOHN COMPANY (US) 1976-10-19 US disclosed
US-3933816-A 3-(Substituted aminomethyl)-7-substituted-3,5-dihydro-as-triazino[4,3-a][1,5]benzodiazepines THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3933794-A CENTRAL NERVOUS SYSTEM DEPRESSANTS THE UPJOHN COMPANY (US) 1976-01-20 US disclosed