SCHEMBL1586513

SCHEMBL1586513

CON=C(C)C1CC1c1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.35
HTR2C P28335 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 1/20 0.34
SLC9A1 P19634 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MAPK1 P28482 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR7 P34969 1/20 0.31
HTR5A P47898 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL11926877 1.00 HPGD (0.35) HPGDHTR2CHTR2AHTR2BL3MBTL1
SCHEMBL1586522 0.90 MEN1 (0.42) HPGDL3MBTL1MAPTMEN1KMT2A
SCHEMBL11926875 0.90 MEN1 (0.42) HPGDL3MBTL1MAPTMEN1KMT2A
SCHEMBL11926878 0.84 L3MBTL1 (0.32) HPGDL3MBTL1MAPTSLC9A1
SCHEMBL1586222 0.84 L3MBTL1 (0.32) HPGDL3MBTL1MAPTSLC9A1
SCHEMBL11926873 0.83 SLC9A1 (0.50) HPGDHTR2CHTR2AHTR2BL3MBTL1
SCHEMBL1586579 0.83 SLC9A1 (0.50) HPGDHTR2CHTR2AHTR2BL3MBTL1
SCHEMBL17134248 0.82 HTR2C (0.36) HTR2CHTR2AHTR2BL3MBTL1SLC9A1
SCHEMBL17134246 0.82 HTR2C (0.36) HTR2CHTR2AHTR2BL3MBTL1SLC9A1
SCHEMBL11926874 0.78 SLC9A1 (0.43) HPGDHTR2CHTR2AHTR2BL3MBTL1

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-2488501-B1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-04-30 EP disclosed
US-8357635-B2 Microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-01-22 US disclosed
EP-2488501-A1 NOVEL MICROBIOCIDES Syngenta Participations AG (CH) 2012-08-22 EP disclosed
US-20120202867-A1 NOVEL MICROBIOCIDES SYNGENTA CROP PROTECTION LLC (US) 2012-08-09 US disclosed
WO-2011045355-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-04-21 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 (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-20120202867-A1 NOVEL MICROBIOCIDES CD14, FPR1, MPO HPGD 624/4885HTR2C 3036/4885HTR2A 3763/4885

“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.