SCHEMBL7708397

SCHEMBL7708397

[CH2]C(C)Oc1c(Br)cc(Br)cc1C(C)CC

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
PPARA Q07869 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
KMT2A Q03164 1/20 0.30
TSHR P16473 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
SCHEMBL7066275 0.83 GABRA1 (0.38) GABRA1GABRB1PPARAALOX15ALOX12
SCHEMBL7061577 0.81 GABRA1 (0.35) GABRA1GABRB1ALOX15ALOX12KMT2A
SCHEMBL7067871 0.77 MEN1 (0.40) GABRA1GABRB1ALOX15ALOX12KMT2A
SCHEMBL7066709 0.75 MEN1 (0.43) GABRA1GABRB1ALOX15ALOX12KMT2A
SCHEMBL7066995 0.75 GABRA1 (0.33) GABRA1GABRB1ALOX15ALOX12KMT2A
SCHEMBL7067636 0.75 THRB (0.38) GABRA1GABRB1PPARAALOX15ALOX12
SCHEMBL1534879 0.75 THRA (0.35) GABRA1GABRB1KMT2A
SCHEMBL7068142 0.74 GABRA1 (0.50) GABRA1GABRB1ALOX15ALOX12KMT2A
SCHEMBL30004700 0.74 THRB (0.35) GABRA1GABRB1PPARAALOX15ALOX12
SCHEMBL448738 0.74 THRB (0.35) GABRA1GABRB1PPARAALOX15ALOX12

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
US-6359170-B1 Brominated materials 3M INNOVATIVE PROPERTIES COMPANY 2002-03-19 US disclosed