SCHEMBL7895029

SCHEMBL7895029

[SiH3]C(Br)(Br)c1ccccc1Br

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA5A P35218 1/20 0.43
CA9 Q16790 1/20 0.43
ALDH1A1 P00352 3/20 0.38
MAPK1 P28482 1/20 0.35
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSD11B1 P28845 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
PLCG1 P19174 1/20 0.30
IDO1 P14902 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
SCHEMBL2266185 0.77 CA1 (0.46) CA1CA2CA5ACA9ALDH1A1
SCHEMBL292047 0.72 ALDH1A1 (0.50) CA1CA2CA5ACA9ALDH1A1
SCHEMBL5080120 0.72 ALDH1A1 (0.43) CA1CA2CA5ACA9ALDH1A1
SCHEMBL29447944 0.72 CA1 (0.54) CA1CA2CA5ACA9ALDH1A1
SCHEMBL3675741 0.72 CA1 (0.54) CA1CA2CA5ACA9ALDH1A1
SCHEMBL10656679 0.72 CA1 (0.43) CA1CA2CA5ACA9ALDH1A1
SCHEMBL363301 0.72 CA1 (0.54) CA1CA2CA5ACA9ALDH1A1
SCHEMBL9512170 0.72 CA1 (0.43) CA1CA2CA5ACA9ALDH1A1
SCHEMBL9275642 0.72 ALDH1A1 (0.43) CA1CA2CA5ACA9ALDH1A1
SCHEMBL30503531 0.72 ALDH1A1 (0.50) CA1CA2CA5ACA9ALDH1A1

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
US-6184341-B1 TREATING THE COPOLYMERS WITH A MONOCARBOXYLIC ACID, PACKAGING FOODSTUFFS, ANTIOXIDANT FUNCTION WITHOUT THE NEED FOR THE ADDITION OF ANTIOXIDANT ADDITIVES, AND LASTLY ARE READILY USABLE. FINA RESEARCH, S.A. (BE) 2001-02-06 US disclosed
US-6048961-A DECOLORING BUTADIENE-STYRENE COPOLYMER IN THE PRESENCE OF ALKALI METAL CATALYST FINA RESEARCH, S.A. (BE) 2000-04-11 US disclosed