SCHEMBL943588

SCHEMBL943588

Cc1cc(CC(Cl)(Cl)Cl)c(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.38
CYP3A4 P08684 1/20 0.35
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL14432237 0.87 CD44 (0.38) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL944491 0.85 CD44 (0.37) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL946586 0.84 CD44 (0.33) CD44CYP3A4
SCHEMBL13191797 0.83 CD44 (0.35) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL5485596 0.81 MAPK1 (0.35) CYP3A4
SCHEMBL12811480 0.75 GRIN2D (0.47) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL195131 0.75 CD44 (0.42) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL22295234 0.74 CD44 (0.38) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL17466153 0.73 CD44 (0.41) CD44CYP3A4GRIN2DGRIN3BGRIN1
SCHEMBL17466157 0.73 CD44 (0.41) CD44CYP3A4GRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875753-B2 formed by reacting aryldiazonium bromide with vinylidene chloride in presence of copper salt and bromide source BAYER CROPSCIENCE AG (DE) 2011-01-25 US disclosed
US-7875753-B2 formed by reacting aryldiazonium bromide with vinylidene chloride in presence of copper salt and bromide source BAYER CROPSCIENCE AG (DE) 2011-01-25 US disclosed
US-7875753-B2 formed by reacting aryldiazonium bromide with vinylidene chloride in presence of copper salt and bromide source BAYER CROPSCIENCE AG (DE) 2011-01-25 US disclosed
WO-2010105739-A1 AROMATIC 2-BROMO-2,2-DICHLOROETHYL COMPOUNDS AND METHODS FOR THE PRODUCTION THEREOF BAYER CROPSCIENCE AG (DE) 2010-09-23 WO disclosed
WO-2010105739-A1 AROMATIC 2-BROMO-2,2-DICHLOROETHYL COMPOUNDS AND METHODS FOR THE PRODUCTION THEREOF BAYER CROPSCIENCE AG (DE) 2010-09-23 WO disclosed
US-20100234651-A1 2-Bromo-2,2-Dichloroethyl Aromatics and Process for Preparation Thereof BAYER CROPSCIENCE AG (DE) 2010-09-16 US disclosed
US-20100234651-A1 2-Bromo-2,2-Dichloroethyl Aromatics and Process for Preparation Thereof BAYER CROPSCIENCE AG (DE) 2010-09-16 US disclosed
US-20100234651-A1 2-Bromo-2,2-Dichloroethyl Aromatics and Process for Preparation Thereof BAYER CROPSCIENCE AG (DE) 2010-09-16 US 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 (1 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-20100234651-A1 2-Bromo-2,2-Dichloroethyl Aromatics and Process for Preparation Thereof AR, AHR, ADRA2C CD44 4648/4885CYP3A4 40/4885GRIN2D 2707/4885

“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.