SCHEMBL17443365

SCHEMBL17443365

CCCC(=NNC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.40
HDAC1 Q13547 4/20 0.40
HDAC2 Q92769 4/20 0.40
HDAC8 Q9BY41 4/20 0.40
FFAR3 O14843 3/20 0.40
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CTSD P07339 1/20 0.34
TSHR P16473 4/20 0.33
HAO1 Q9UJM8 1/20 0.32
ALDH1A1 P00352 3/20 0.32
ALOX15 P16050 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
AKR1B1 P15121 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 2/20 0.30
PPARG P37231 4/20 0.30
PPARD Q03181 4/20 0.30
PPARA Q07869 4/20 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
SCHEMBL1805494 0.77 HIF1A (0.39) HDAC3HDAC1HDAC2HDAC8FFAR3
SCHEMBL3335899 0.73
SCHEMBL10978667 0.73
SCHEMBL4785776 0.70 HDAC3 (0.42) HDAC3HDAC1HDAC2HDAC8FFAR3
SCHEMBL23958618 0.65
SCHEMBL17620521 0.65
SCHEMBL11114847 0.65 FFAR3 (0.37) HDAC3HDAC1HDAC2HDAC8FFAR3
Butyric Acid SCHEMBL1615529 0.64
SCHEMBL17621147 0.64
Butyric Acid SCHEMBL2052085 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11330821-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2022-05-17 US disclosed
EP-3288934-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-09-04 EP disclosed
EP-3169668-B1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-09-04 EP disclosed
US-20180116219-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-05-03 US disclosed
US-9944608-B2 Herbicidal pyridazinone derivatives SYNGENTA PARTICIPATIONS AG (CH) 2018-04-17 US disclosed
EP-3288934-A1 HERBICIDAL COMPOUNDS Syngenta Participations AG (CH) 2018-03-07 EP disclosed
US-20170166535-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-15 US disclosed
EP-3169668-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES Syngenta Participations AG (CH) 2017-05-24 EP disclosed
WO-2016174072-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-11-03 WO disclosed
WO-2016008816-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 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 (3 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-11330821-B2 Herbicidal compounds DDT, HPD, HDHD5 HDAC3 572/4885HDAC1 1041/4885HDAC2 667/4885
US-20180116219-A1 HERBICIDAL COMPOUNDS DDT, HPD, HDHD5 HDAC3 572/4885HDAC1 1041/4885HDAC2 667/4885
US-20170166535-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES HPD, DDT, PDXK HDAC3 786/4885HDAC1 900/4885HDAC2 1036/4885

“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.