SCHEMBL3328532

SCHEMBL3328532

COCCOc1c(Cl)ccc(-c2cc(N)c(Cl)c(C(=O)OC)n2)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.38
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
RCE1 Q9Y256 1/20 0.36
ALPL P05186 2/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
NQO2 P16083 1/20 0.35
KAT6A Q92794 1/20 0.34
KAT8 Q9H7Z6 1/20 0.34
HPGD P15428 2/20 0.34
MAP4K1 Q92918 2/20 0.34
PTGES O14684 2/20 0.33
P2RX7 Q99572 1/20 0.33
PRKD3 O94806 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
PRKD2 Q9BZL6 1/20 0.33

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
SCHEMBL3330292 0.92 KDM4E (0.36) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3326935 0.91 CNR1 (0.40) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3333328 0.91 MAPK1 (0.37) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3327374 0.91 ALOX5AP (0.38) ALPLALOX5APFEN1HPGDMAP4K1
SCHEMBL29442558 0.88 KDM4E (0.40) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL115368 0.88 KDM4E (0.40) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL29423657 0.88 KDM4E (0.40) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3329184 0.88 ALOX5AP (0.36) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3327575 0.84 KDM4E (0.37) S1PR4KDM4EPKMRCE1ALPL
SCHEMBL3332442 0.84 MAP4K1 (0.39) S1PR4KDM4EPKMRCE1ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP claimed
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP disclosed
US-8962523-B2 Herbicide/safener combination BAYER CROPSCIENCE AG (DE) 2015-02-24 US disclosed
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2015-02-19 US disclosed
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
EP-1973881-B1 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2009-10-28 EP disclosed
EP-2060566-A1 Poly-substituted aryls Dow AgroSciences LLC (US) 2009-05-20 EP disclosed
US-7498468-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-03-03 US disclosed
EP-1973881-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2008-10-01 EP disclosed
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-28 US disclosed
US-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-21 US disclosed
US-7314849-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-01-01 US disclosed
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2007-08-02 US disclosed
WO-2007082098-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2007-07-19 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 (5 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-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC S1PR4 4054/4885KDM4E 672/4885PKM 1973/4885
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 S1PR4 4235/4885KDM4E 4579/4885PKM 3491/4885
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC S1PR4 4054/4885KDM4E 672/4885PKM 1973/4885
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC S1PR4 4054/4885KDM4E 672/4885PKM 1973/4885
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 S1PR4 4235/4885KDM4E 4579/4885PKM 3491/4885

“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.