SCHEMBL7329155

SCHEMBL7329155

O=c1[nH]c2c(c3nc(-c4ccccc4Cl)cn13)CNCC2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRA3 P34903 9/20 0.49
GABRA2 P47869 9/20 0.49
GABRA1 P14867 8/20 0.49
GABRA5 P31644 3/20 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
SCHEMBL7335981 0.87 GABRA3 (0.64) GABRA3GABRA2GABRA1GABRA5
SCHEMBL8103227 0.85 GABRA3 (0.52) GABRA3GABRA2GABRA1GABRA5
SCHEMBL7338092 0.84 GABRA2 (0.60) GABRA3GABRA2GABRA1GABRA5
SCHEMBL9001207 0.81 MAPK13 (0.54) GABRA3GABRA2GABRA1GABRA5
SCHEMBL7337187 0.77 GABRA2 (0.58) GABRA3GABRA2GABRA1GABRA5
SCHEMBL7328607 0.76 GABRA2 (0.62) GABRA3GABRA2GABRA1GABRA5
SCHEMBL7329523 0.75 GABRA1 (0.60) GABRA3GABRA2GABRA1GABRA5
SCHEMBL8096736 0.71 GABRA3 (0.67) GABRA3GABRA2GABRA1GABRA5
SCHEMBL8885602 0.69 GABRA3 (0.51) GABRA3GABRA2GABRA1GABRA5
SCHEMBL8094714 0.68 GABRA2 (0.64) GABRA3GABRA2GABRA1GABRA5

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
US-5095015-A G-aminobutyric acid, anticonvulsants, tranquilizers, sleep disorders NEUROGEN CORPORATION (US) 1992-03-10 US claimed
US-5510480-A FOR SELECTIVE BINDING WITH GAMMA-AMINOBUTYRIC ACID RECEPTORS NEUROGEN CORPORATION (US) 1996-04-23 US disclosed
US-5328912-A Psychological disorders, cognition activators NEUROGEN CORPORATION (US) 1994-07-12 US disclosed
EP-0536295-A1 CERTAIN AZACYCLOALKYL IMIDAZOPYRIMIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1993-04-14 EP disclosed
WO-1992000296-A1 CERTAIN AZACYCLOALKYL IMIDAZOPYRIMIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1992-01-09 WO disclosed