SCHEMBL7796080

SCHEMBL7796080

C=Cc1ccc(CC)c(C=C)c1C=C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34

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
SCHEMBL420437 0.84 GABRA1 (0.43) GABRA1GABRB2
SCHEMBL29051014 0.83 PDXK (0.30)
SCHEMBL29144410 0.83
SCHEMBL11668057 0.80 GABRA1 (0.39) GABRA1GABRB2
SCHEMBL29623714 0.80 ALDH1A1 (0.39)
SCHEMBL5241695 0.80 ALDH1A1 (0.39)
SCHEMBL8820420 0.78
SCHEMBL1363486 0.78 GABRA1 (0.50) GABRA1GABRB2
SCHEMBL28115439 0.78 GABRA1 (0.38) GABRA1GABRB2
SCHEMBL29184986 0.77 GABRA1 (0.34) 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-1123327-A1 SOLID SUPPORTS CONTAINING SCINTILLANT The Nottingham Trent University (GB) 2001-08-16 EP disclosed
WO-2000020475-A1 SOLID SUPPORTS CONTAINING SCINTILLANT THE NOTTINGHAM TRENT UNIVERSITY (GB) 2000-04-13 WO disclosed