SCHEMBL517581

SCHEMBL517581

CCOP(=O)(OCC)C(Br)(Br)c1ccc(Br)c(Br)c1Br

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
KCNH2 Q12809 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
TSHR P16473 1/20 0.30
GAA P10253 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 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
SCHEMBL518474 0.84 CYP3A4 (0.38) CA12CA1CA2CA9TSHR
SCHEMBL518216 0.82 TSHR (0.31) TSHR
SCHEMBL518053 0.82 POLB (0.34) POLBNPSR1TSHRGAA
SCHEMBL517780 0.80 EGFR (0.34) TSHR
SCHEMBL518217 0.77 POLB (0.44) POLBNPSR1KCNH2TSHRGAA
SCHEMBL518054 0.71 POLB (0.38) POLBNPSR1CA12CA1CA2
SCHEMBL517781 0.71 POLB (0.38) POLBNPSR1CA12CA1CA2
SCHEMBL3206782 0.71 CDC14B (0.36)
SCHEMBL517591 0.69 GAA (0.34) GAA
SCHEMBL517977 0.67 CYP3A4 (0.33) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120029224-A1 PROCESS FOR THE PREPARATION OF HALOGENATED ARYL PHOSPHONATES BROMINE COMPOUNDS LTD. (IL) 2012-02-02 US claimed
WO-2010046898-A1 A PROCESS FOR THE PREPARATION OF HALOGENATED ARYL PHOSPHONATES BROMINE COMPOUNDS LTD. (IL) 2010-04-29 WO claimed
US-8405069-B2 Printable thin-film transistors with high dielectric constant gate insulators and methods for producing same GEORGIA TECH RESEARCH CORPORATION (US) 2013-03-26 US disclosed
US-20120029224-A1 PROCESS FOR THE PREPARATION OF HALOGENATED ARYL PHOSPHONATES BROMINE COMPOUNDS LTD. (IL) 2012-02-02 US disclosed
US-7960456-B2 Halogenated phosphonates, processes for their preparation and their use as flame retardants BROMINE COMPOUNDS LTD. (IL) 2011-06-14 US disclosed
US-20100305252-A1 Halogenated Phosphonates, Processes for Their Preparation and Their Use as Flame Retardants BROMINE COMPOUNDS LTD. (IL) 2010-12-02 US disclosed
WO-2010046898-A1 A PROCESS FOR THE PREPARATION OF HALOGENATED ARYL PHOSPHONATES BROMINE COMPOUNDS LTD. (IL) 2010-04-29 WO disclosed
US-20100051917-A1 PRINTABLE THIN-FILM TRANSISTORS WITH HIGH DIELECTRIC CONSTANT GATE INSULATORS AND METHODS FOR PRODUCING SAME NATIONAL SCIENCE FOUNDATION 2010-03-04 US disclosed
US-20100027192-A1 COATED METAL OXIDE NANOPARTICLES AND METHODS FOR PRODUCING SAME GEORGIA TECH RESEARCH CORPORATION 2010-02-04 US disclosed
WO-2008060534-A1 PRINTABLE THIN-FILM TRANSISTORS WITH HIGH DIELECTRIC CONSTANT GATE INSULATORS AND METHODS FOR PRODUCING SAME GEORGIA TECH RESEARCH CORPORATION (US) 2008-05-22 WO disclosed
EP-1888311-A2 COATED METAL OXIDE NANOPARTICLES AND METHODS FOR PRODUCING SAME GEORGIA TECH RESEARCH CORPORATION (US) 2008-02-20 EP disclosed
WO-2006124670-A2 COATED METAL OXIDE NANOPARTICLES AND METHODS FOR PRODUCING SAME GEORGIA TECH RESEARCH CORPORATION (US) 2006-11-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100305252-A1 Halogenated Phosphonates, Processes for Their Preparation and Their Use as Flame Retardants POLL, PFAS, POLN POLB 6/4885NPSR1 3002/4885KCNH2 1142/4885
US-20100027192-A1 COATED METAL OXIDE NANOPARTICLES AND METHODS FOR PRODUCING SAME NCL, PNN, NCDN POLB 3047/4885NPSR1 828/4885KCNH2 1419/4885
US-20120029224-A1 PROCESS FOR THE PREPARATION OF HALOGENATED ARYL PHOSPHONATES PIK3CA, PIP5K1B, PIP5K1C POLB 1353/4885NPSR1 3576/4885KCNH2 1004/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.