SCHEMBL24554

SCHEMBL24554

CC(C)Cc1ccc[c]c1Cl

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.45
GABRB2 P47870 2/20 0.45
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL23541 0.81 SLC6A2 (0.41) GABRA1GABRB2SLC6A2SLC6A4SLC6A3
SCHEMBL24394 0.81
SCHEMBL19405397 0.80 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL310156 0.78 GABRA1 (0.47) GABRA1GABRB2
SCHEMBL456598 0.77
SCHEMBL9689790 0.76
SCHEMBL4563689 0.76 GABRA1 (0.55) GABRA1GABRB2
SCHEMBL919938 0.76 GABRA1 (0.45) GABRA1GABRB2
SCHEMBL9322497 0.73 PPARG (0.32)
SCHEMBL19405447 0.73 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3

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