SCHEMBL30057734

SCHEMBL30057734

Brc1cc(Br)c(Br)c(-c2c(Br)c(Br)cc(Br)c2Br)c1Br

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.56
CA4 P22748 2/20 0.56
CA1 P00915 1/20 0.56
CA6 P23280 1/20 0.56
APEX1 P27695 1/20 0.50
TDP1 Q9NUW8 2/20 0.38
AHR P35869 3/20 0.38
AKR1B1 P15121 1/20 0.33
MAPT P10636 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
GAA P10253 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
SCHEMBL356679 0.78 TDP1 (0.56) CA2CA4CA1CA6APEX1
SCHEMBL31070426 0.75 TDP1 (0.40) CA2CA4CA1CA6APEX1
SCHEMBL29091211 0.73 CRHBP (0.44) CA2CA4CA1CA6APEX1
SCHEMBL68500 0.72 CA1 (1.00) CA2CA4CA1CA6APEX1
Ethylene SCHEMBL27257227 0.72 TDP1 (0.50) CA2CA4CA1CA6APEX1
Ethylene SCHEMBL3851523 0.72 TDP1 (0.50) CA2CA4CA1CA6APEX1
Ethane SCHEMBL27516377 0.72 TDP1 (0.50) CA2CA4CA1CA6APEX1
Bromomethane SCHEMBL27669607 0.72 TDP1 (0.50) CA2CA4CA1CA6APEX1
SCHEMBL356698 0.71 AHR (0.50) CA2CA4CA1CA6APEX1
SCHEMBL12816712 0.69 APEX1 (0.44) CA2CA4CA1CA6APEX1

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
CN-115552349-A Multi-layer circuit with common rail 森萨塔科技公司 2022-12-30 CN disclosed