SCHEMBL10666232

SCHEMBL10666232

CCOc1nn2c(-c3ccccc3)nnc2c2ccccc12

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 20/20 0.74
GABRB3 P28472 20/20 0.74
GABRA3 P34903 20/20 0.74
GABRA1 P14867 19/20 0.74
GABRA5 P31644 18/20 0.74
GABRA2 P47869 17/20 0.74

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
SCHEMBL10666391 0.89 GABRA1 (0.77) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL7452389 0.83 GABRG2 (0.53) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10662241 0.82 GABRG2 (0.51) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL2652789 0.80 GABRA1 (1.00) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL6847244 0.79 GABRA1 (0.74) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10667833 0.77 GABRA1 (0.76) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10660698 0.76 GABRA1 (0.74) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10667452 0.75 GABRA1 (0.67) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10667033 0.75 NPC1 (0.62) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL10667963 0.74 NPC1 (0.61) GABRG2GABRB3GABRA3GABRA1GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4788186-A ANXIOLYTIC AGENTS GRUPPO LEPETIT S.P.A. (IT) 1988-11-29 US claimed
US-4788186-A ANXIOLYTIC AGENTS GRUPPO LEPETIT S.P.A. (IT) 1988-11-29 US disclosed
EP-0085840-B1 NEW 6-SUBSTITUTED-S-TRIAZOLO(3,4-A)PHTHALAZINE DERIVATIVES GRUPPO LEPETIT S.P.A. (IT) 1986-10-01 EP disclosed
EP-0085840-A1 New 6-substituted-s-triazolo(3,4-a)phthalazine derivatives GRUPPO LEPETIT S.P.A. (IT) 1983-08-17 EP disclosed