SCHEMBL4948729

SCHEMBL4948729

Brc1ccccc1C(c1c(Br)c(Br)c(Br)c(Br)c1Br)(C(Br)(Br)Br)C(Br)(Br)Br

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA5A P35218 1/20 0.38
CA9 Q16790 1/20 0.38
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.31
PLCG1 P19174 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
SCHEMBL4948758 0.84
SCHEMBL94425 0.77 CA1 (0.38) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4810533 0.76 CA1 (0.41) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4949691 0.74 CA1 (0.39) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4949944 0.74 KCNN4 (0.35) ALDH1A1MAPK1
SCHEMBL3976943 0.74 CA1 (0.36) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4944376 0.74 CA1 (0.36) CA1CA2CA5ACA9ALDH1A1
Ethane SCHEMBL9862554 0.74 CA1 (0.36) CA1CA2CA5ACA9ALDH1A1
Ethane SCHEMBL18094356 0.71 CA1 (0.37) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4950998 0.71 CA1 (0.37) 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 5 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