SCHEMBL24008

SCHEMBL24008

CC(C)Cc1ccc[c]c1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40

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
SCHEMBL18691344 0.93 GABRA1 (0.38) GABRA1GABRB2
SCHEMBL454639 0.80 NR3C1 (0.35) GABRA1GABRB2
SCHEMBL16950506 0.77 HTR2A (0.31)
SCHEMBL17046394 0.77 APOBEC3G (0.32)
SCHEMBL16960717 0.73 GABRA1 (0.34) GABRA1GABRB2
SCHEMBL7429724 0.72 PRCP (0.31)
SCHEMBL310156 0.72 GABRA1 (0.47) GABRA1GABRB2
SCHEMBL919938 0.71 GABRA1 (0.45) GABRA1GABRB2
SCHEMBL24554 0.71 GABRA1 (0.45) GABRA1GABRB2
SCHEMBL4563689 0.71 GABRA1 (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588480-A2 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF& xA; SANOFI (FR) 2013-05-08 EP disclosed
WO-2011161537-A2 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-29 WO disclosed