SCHEMBL9075243

SCHEMBL9075243

O=C(c1ccc(C(F)(F)F)cc1)N1Cc2c(-c3ccc(F)cc3)ncn2-c2ccccc21

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.49
GABRB2 P47870 1/20 0.49
GABRA6 Q16445 1/20 0.49

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
SCHEMBL9077683 0.84
SCHEMBL9077322 0.84
SCHEMBL9076611 0.82
SCHEMBL8998552 0.81
SCHEMBL9075575 0.78 GABRA1 (0.58) GABRA1GABRB2
SCHEMBL9077866 0.78
SCHEMBL9077933 0.78
SCHEMBL9078343 0.78
SCHEMBL9077976 0.77 GABRA1 (0.59) GABRA1GABRB2GABRA6
SCHEMBL9077768 0.76 GABRA1 (0.60) GABRA1GABRB2

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-5541324-A Imidazo[1,5-A]quinoxalines THE UPJOHN COMPANY (US) 1996-07-30 US claimed
EP-0590022-A1 IMIDAZO 1,5-a]QUINOXALINES PHARMACIA & UPJOHN COMPANY (US) 1994-04-06 EP claimed
WO-1992022552-A1 IMIDAZO[1,5-a]QUINOXALINES THE UPJOHN COMPANY (US) 1992-12-23 WO claimed