SCHEMBL2339787

SCHEMBL2339787

CC(C)Nc1cc(Cl)nc(C(=O)O)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.36
HCAR3 P49019 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
S1PR2 O95136 1/20 0.33
NR4A2 P43354 1/20 0.33
PIK3CA P42336 6/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
IRAK4 Q9NWZ3 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
SCHEMBL2339598 0.81 TDP1 (0.38) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL15063403 0.79 KDM4E (0.45) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL2342690 0.77 ALDH1A1 (0.40) HCAR3TDP1MEN1KMT2AALDH1A1
Dimethylamine SCHEMBL17110604 0.73 TDP1 (0.44) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL27518235 0.73 CYP2C19 (0.43) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL2343067 0.73 CISD1 (0.45) HCAR3SMN1; SMN2NR4A2CYP2C9
SCHEMBL15032599 0.72 ALDH1A1 (0.48) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL2347014 0.71 TDP1 (0.44) TDP1MEN1KMT2AALDH1A1MAPK1
SCHEMBL30836976 0.71 IRAK4 (0.41) KAT2BHCAR3IRAK4
SCHEMBL15110350 0.71 IRAK4 (0.41) KAT2BHCAR3IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498413-B1 4-Aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2011-08-31 EP disclosed
EP-1246802-B1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2007-03-14 EP disclosed
CN-1281591-C 4-aminopyridinecarboxylates and their use as herbicides DOW AGROSCIENCES LLC (US) 2006-10-25 CN disclosed
EP-1498413-A1 4-Aminopicolinates and their use as herbicides Dow AgroSciences LLC (US) 2005-01-19 EP disclosed
US-20010047099-A1 4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC 2001-11-29 US disclosed
US-6297197-B1 DEMONSTRATING A BROAD SPECTRUM OF WEED CONTROL. DOW AGROSCIENCES LLC 2001-10-02 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-20010047099-A1 4-aminopicolinates and their use as herbicides AADAT, ABAT, DDT KAT2B 4092/4885HCAR3 10/4885TDP1 3400/4885

“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.