SCHEMBL1224322

SCHEMBL1224322

COc1cc(-c2nc(N)c(Cl)c(C(=O)O)n2)c(F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 0.38
HSP90AA1 P07900 2/20 0.37
HSP90AB1 P08238 2/20 0.37
DHPS P49366 1/20 0.37
RAB9A P51151 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KMO O15229 1/20 0.36
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
STING1 Q86WV6 1/20 0.34
NPC1 O15118 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
DPP4 P27487 1/20 0.34
SUV39H2 Q9H5I1 1/20 0.34
TTR P02766 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
SCHEMBL1222964 0.89 GAA (0.39) HSP90AA1HSP90AB1DHPSRAB9ALMNA
SCHEMBL1397064 0.89 DHPS (0.43) GRK6HSP90AA1HSP90AB1DHPSRAB9A
SCHEMBL1477814 0.86 TDP1 (0.38) LMNAKMODPP4
SCHEMBL27911272 0.83 GRK6 (0.39) GRK6HSP90AA1HSP90AB1DHPSRAB9A
SCHEMBL1918041 0.81 GAA (0.38) HSP90AA1HSP90AB1DHPSRAB9ALMNA
SCHEMBL27911271 0.81 TNFSF11 (0.36) GRK6HSP90AA1HSP90AB1DHPSRAB9A
SCHEMBL2464538 0.81 GRK6 (0.38) GRK6HSP90AA1HSP90AB1RAB9ALMNA
SCHEMBL2469994 0.81 HSP90AA1 (0.42) GRK6HSP90AA1HSP90AB1RAB9ALMNA
SCHEMBL1478092 0.80 TDP1 (0.36) MAPK1KMOSMN1; SMN2ALDH1A1
SCHEMBL1397063 0.80 DHPS (0.40) DHPSKMOKDM4EGAAMAPT

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
CN-102977036-A 2-(poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DOW AGROSCIENCES LLC 2013-03-20 CN disclosed
US-7888287-B2 6-Amino-5-chloro-2-(4-chloro-2,6-difluoro-3-methoxy-phenyl)pyrimidine-4-carboxylic Acid Methyl Ester; preemergence herbicides; applying to the soil in rice fields; broad spectrum of weed control against woody plants, grasses and sedges as well as broadleafs DOW AGROSCIENCES LLC (US) 2011-02-15 US disclosed
EP-1971579-B1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2010-07-28 EP disclosed
US-20090149329-A1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (IN) 2009-06-11 US disclosed
US-7538214-B2 2-(poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-05-26 US disclosed
EP-1971579-A1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2008-09-24 EP disclosed
US-20080091016-A1 2-(Poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-04-17 US disclosed
US-7300907-B2 2-(Poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DOW AGROSCIENCES LLC (US) 2007-11-27 US disclosed
US-20070179059-A1 2-(Poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides CORTEVA AGRISCIENCE LLC 2007-08-02 US disclosed
WO-2007082076-A1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS 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 (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-20090149329-A1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS AND THEIR USE AS HERBICIDES DDT, DDC, HDHD5 GRK6 1047/4885HSP90AA1 1128/4885HSP90AB1 1410/4885
US-20080091016-A1 2-(Poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DDT, DDC, HDHD5 GRK6 1047/4885HSP90AA1 1128/4885HSP90AB1 1410/4885
US-20070179059-A1 2-(Poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DDT, DDC, HDHD5 GRK6 1047/4885HSP90AA1 1128/4885HSP90AB1 1410/4885

“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.