SCHEMBL20032412

SCHEMBL20032412

CC(Br)c1cc(Br)cc(CBr)c1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30

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
SCHEMBL5883422 0.83 IDO1 (0.31)
SCHEMBL31668166 0.79 GABRA1 (0.39) GABRA1GABRB1
SCHEMBL18093834 0.79 GABRA1 (0.39) GABRA1GABRB1
SCHEMBL642402 0.74 IDO1 (0.40)
SCHEMBL400236 0.74 IDO1 (0.46)
SCHEMBL31039376 0.71 ALDH1A1 (0.36) GABRA1GABRB1
SCHEMBL25388789 0.71 TSHR (0.41)
SCHEMBL3592509 0.70 CHRNB4 (0.34) GABRA1GABRB1
SCHEMBL29988864 0.70 CHRNB4 (0.34) GABRA1GABRB1
SCHEMBL9616495 0.69 IDO1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018060280-A1 ENDOSOMOLYTIC AGENTS FOR GENE THERAPY UCB BIOPHARMA SPRL (BE) 2018-04-05 WO disclosed