SCHEMBL4949544

SCHEMBL4949544

Brc1cccc(C(Br)(Br)C(Br)(Br)C(Br)(Br)C(Br)(Br)c2ccccc2)c1Br

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
KCNN4 O15554 1/20 0.30
MAPK1 P28482 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
SCHEMBL4951332 0.85 ALDH1A1 (0.32) ALDH1A1TDP1KCNN4
SCHEMBL9016955 0.78 ALDH1A1 (0.33) ALDH1A1TDP1CA1CA2CA5A
SCHEMBL29197463 0.78 ALDH1A1 (0.33) ALDH1A1TDP1CA1CA2CA5A
SCHEMBL4947950 0.76
SCHEMBL8854169 0.76 KCNN4 (0.41) ALDH1A1CA1CA2CA5ACA9
SCHEMBL4813318 0.76 CA1 (0.30) CA1CA2CA5ACA9
SCHEMBL4944865 0.76 CA1 (0.30) CA1CA2CA5ACA9
SCHEMBL4948749 0.76 ALDH1A1 (0.31) ALDH1A1TDP1
SCHEMBL4947666 0.75 KCNN4 (0.34) ALDH1A1TDP1KCNN4MAPK1
SCHEMBL653490 0.74 CA1 (0.32) ALDH1A1CA1CA2CA5ACA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378449-B2 Poly(bromoaryl)alkane additives and methods for their preparation and use ALBEMARLE CORPORATION (US) 2008-05-27 US disclosed
US-20070093582-A1 POLY(BROMOARYL)ALKANE ADDITIVES AND METHODS FOR THEIR PREPARATION AND USE ALBEMARLE CORPORATION (US) 2007-04-26 US disclosed
US-7129385-B2 Poly(bromoaryl)alkane additives and methods for their preparation and use ALBEMARLE CORPORATION (US) 2006-10-31 US disclosed
US-20040195087-A1 Poly(bromoaryl)alkane additives and methods for their preparation and use ALBEMARLE CORPORATION 2004-10-07 US disclosed
US-6743825-B1 Poly(bromoaryl)alkane additives and methods for their preparation and use ALBEMARLE CORPORATION 2004-06-01 US disclosed
US-4981890-A POLYHALOAROMATIC AND AROMATIC BIS-SULFONAMIDE ETHYL CORPORATION (US) 1991-01-01 US disclosed
US-4957957-A Polymer compositions containing aromatic sulfonamide ETHYL CORPORATION (US) 1990-09-18 US disclosed