SCHEMBL695601

SCHEMBL695601

FC(F)(F)c1cc(Oc2ccccc2)ccc1CBr

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.42
MGLL Q99685 1/20 0.41
AR P10275 8/20 0.40
PDK2 Q15119 1/20 0.39
LTA4H P09960 1/20 0.39
TSHR P16473 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
NR1H2 P55055 4/20 0.38
NR1H3 Q13133 4/20 0.38
LOX P28300 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
RXRA P19793 1/20 0.38
IDO1 P14902 1/20 0.38

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
SCHEMBL758543 0.92 AR (0.41) EPHX2ARIDO1
SCHEMBL695762 0.90 PDK2 (0.39) MGLLARPDK2LTA4HTSHR
SCHEMBL694728 0.85 LTA4H (0.50) EPHX2MGLLARPDK2LTA4H
SCHEMBL694270 0.80 AR (0.51) ARPDK2PPARG
SCHEMBL695243 0.78 EPHX2 (0.54) EPHX2PPARG
SCHEMBL1129534 0.78 MEN1 (0.44) MGLLARPDK2LTA4HTSHR
SCHEMBL506626 0.78 LTA4H (0.43) LTA4HTSHRNR1H2
SCHEMBL696462 0.77 LTA4H (0.49) PDK2LTA4HTSHRNR1H2NR1H3
SCHEMBL27531729 0.77 LTA4H (0.57) EPHX2ARLTA4HNR1H2NR1H3
SCHEMBL17274291 0.76 NAAA (0.50) LTA4HTSHRNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421835-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INHIBITORS Glaxo Group Limited (GB) 2012-02-29 EP disclosed
WO-2010122089-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INHIBITORS GLAXO GROUP LIMITED (GB) 2010-10-28 WO disclosed
US-20100273744-A1 COMPOUNDS GORE PAUL MARTIN 2010-10-28 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-20100273744-A1 COMPOUNDS LTC4S, HRH4, HRH2 EPHX2 367/4885MGLL 1257/4885AR 1582/4885

“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.