SCHEMBL8966944

SCHEMBL8966944

BrB(c1ccccc1)c1ccccc1.ClB(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.42
ORAI2 Q96SN7 3/20 0.42
ORAI3 Q9BRQ5 3/20 0.42
TRPV6 Q9H1D0 3/20 0.42
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
ENPP2 Q13822 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
PCSK9 Q8NBP7 1/20 0.38
BBOX1 O75936 2/20 0.32
EHMT2 Q96KQ7 2/20 0.32
EHMT1 Q9H9B1 2/20 0.32
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL2222360 0.86 TRPV6 (0.47) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL2218862 0.86 ORAI1 (0.53) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL29194250 0.83 ORAI1 (0.50) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL23533754 0.74 MGLL (0.54) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL17352041 0.70 MGLL (0.56) ORAI1ORAI2ORAI3TRPV6ALDH1A1
SCHEMBL115344 0.67
SCHEMBL29602 0.67
SCHEMBL17796990 0.65
SCHEMBL29260691 0.65
SCHEMBL15375793 0.63 ORAI1 (0.38) ORAI1ORAI2ORAI3TRPV6CA4

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
EP-0404503-B1 Boron-containing, silicon nitride-based ceramic shaped body production process TONEN CORP (JP) 1996-03-06 EP disclosed
EP-0389084-B1 Process for producing a polyborosilazane TONEN CORP (JP) 1995-09-20 EP disclosed
US-5128286-A BORON-CONTAINING, SILICON NITRIDE-BASED CERAMIC SHAPED BODY TONEN CORPORATION (JP) 1992-07-07 US disclosed
US-5030744-A Polyborosilazane and process for producing same TONEN CORPORATION (JP) 1991-07-09 US disclosed
EP-0404503-A1 Boron-containing, silicon nitride-based ceramic shaped body production process Tonen Corporation (JP) 1990-12-27 EP disclosed