SCHEMBL515650

SCHEMBL515650

CCc1cc(Oc2ccc(Cl)cc2)ccc1C1C(=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
HTR2A P28223 3/20 0.39
SLC6A4 P31645 3/20 0.39
KCNH2 Q12809 3/20 0.39
TAAR1 Q96RJ0 1/20 0.39
LMNA P02545 1/20 0.38
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
ADAMTS5 Q9UNA0 1/20 0.37
PPARG P37231 1/20 0.37
S1PR5 Q9H228 1/20 0.35
BCHE P06276 1/20 0.34
SLC2A1 P11166 1/20 0.34
ACHE P22303 1/20 0.34
MMP14 P50281 2/20 0.34
MMP13 P45452 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34

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
SCHEMBL1742467 0.79 ALDH1A1 (0.38) ALDH1A1HTR2ASLC6A4KCNH2TAAR1
SCHEMBL407171 0.79 ALDH1A1 (0.39) ALDH1A1SLC6A4LMNAMAOAMAOB
SCHEMBL401599 0.77 HTR2A (0.39) HTR2ASLC6A4KCNH2ADAMTS5
SCHEMBL407940 0.72 PNLIP (0.39) ALDH1A1SLC6A4LMNAMAOAMAOB
SCHEMBL419311 0.71 HTR2A (0.36) ALDH1A1HTR2ASLC6A4KCNH2LMNA
SCHEMBL28659130 0.71 HTR2A (0.50) ALDH1A1HTR2ASLC6A4KCNH2MAOA
SCHEMBL414221 0.70 SLC6A4 (0.40) HTR2ASLC6A4KCNH2
SCHEMBL15186258 0.69 HTR2A (0.47) ALDH1A1HTR2ASLC6A4KCNH2MAOA
SCHEMBL405747 0.69 MAOA (0.35) ALDH1A1HTR2ASLC6A4KCNH2TAAR1
SCHEMBL516287 0.69 MAOB (0.36) ALDH1A1HTR2ASLC6A4KCNH2LMNA

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-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
EP-2393769-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2011-12-14 EP disclosed
WO-2010089210-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-08-12 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ALDH1A1 14/4885HTR2A 1320/4885SLC6A4 1443/4885

“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.