SCHEMBL2345281

SCHEMBL2345281

CN(C)c1cc(Cl)nc(C(=O)O)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 5/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
S1PR2 O95136 2/20 0.35
HCAR2 Q8TDS4 1/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 4/20 0.33
GPR35 Q9HC97 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
ATM Q13315 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
LMNA P02545 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
SCHEMBL27519131 0.88 TDP1 (0.37) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL753241 0.78 MCL1 (0.40) KDM4ERXRARXRBRXRG
SCHEMBL27586891 0.77 TDP1 (0.40) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL13279710 0.76 NPC1 (0.35) MEN1KMT2ALMNA
SCHEMBL15032599 0.76 ALDH1A1 (0.48) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL2347014 0.75 TDP1 (0.44) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL15731244 0.75 POLB (0.36) ALDH1A1MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL27691281 0.73 TDP1 (0.41) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL29390992 0.72 TDP1 (0.50) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1
SCHEMBL116082 0.72 TDP1 (0.50) TDP1ALDH1A1MAPK1SMN1; SMN2MEN1

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-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
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 TDP1 3400/4885ALDH1A1 855/4885MAPK1 3604/4885

“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.