SCHEMBL407384

SCHEMBL407384

CCc1ccc(Oc2ccc(Cl)cc2)cc1C1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@@H]2O1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
HTR2A P28223 3/20 0.34
SLC6A4 P31645 3/20 0.34
KCNH2 Q12809 3/20 0.34
TAAR1 Q96RJ0 1/20 0.34
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
SCN9A Q15858 1/20 0.32
PDE4A P27815 1/20 0.32

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
SCHEMBL405747 0.85 MAOA (0.35) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL419311 0.78 HTR2A (0.36) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL2122975 0.76 ALDH1A1 (0.38) ALDH1A1MAPTHPGDHTTNPC1
SCHEMBL416156 0.76 MMP14 (0.36) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL13058442 0.71 MAPT (0.38) TAAR1ALDH1A1MAPTHTTMEN1
SCHEMBL3248786 0.71 MAPT (0.38) TAAR1ALDH1A1MAPTHTTMEN1
SCHEMBL28659130 0.68 HTR2A (0.50) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL15186258 0.67 HTR2A (0.47) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL515650 0.67 ALDH1A1 (0.40) MAOAMAOBHTR2ASLC6A4KCNH2
SCHEMBL452406 0.67 TAAR1 (0.36) HTR2AKCNH2TAAR1ALDH1A1MAPT

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-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAOA 2359/4885MAOB 2064/4885HTR2A 1320/4885

“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.