SCHEMBL2467526

SCHEMBL2467526

Nc1cc(-c2ccccc2F)nc(C(=O)O)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.46
ADORA2A P29274 6/20 0.42
ADORA1 P30542 5/20 0.42
ADORA3 P0DMS8 4/20 0.42
ADORA2B P29275 1/20 0.42
PIM3 Q86V86 4/20 0.41
PIM2 Q9P1W9 4/20 0.41
PIM1 P11309 3/20 0.41
MPL P40238 1/20 0.41
DHODH Q02127 1/20 0.39
PARP1 P09874 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
EIF4E P06730 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL2464095 0.86 HSP90AA1 (0.49) ATRADORA2AADORA1KDM5BNPC1
SCHEMBL2466887 0.85 KMO (0.49) ADORA2AADORA1DHODHEIF4ENPC1
SCHEMBL2468069 0.85 KMO (0.53) PIM3DHODHEIF4E
SCHEMBL2465207 0.84 CYP3A4 (0.38) ATRPIM3PIM2PIM1DHODH
SCHEMBL2468298 0.84 ADORA2A (0.44) ATRADORA2AADORA1ADORA3ADORA2B
SCHEMBL2469197 0.83 PRKDC (0.46) ATRADORA2AADORA1EIF4ENPC1
SCHEMBL16075455 0.83 KMO (0.40) ATRPIM3PIM2PIM1
SCHEMBL16075432 0.83 KMO (0.40) DHODHNPC1RAB9A
SCHEMBL2464665 0.83 GRM2 (0.42) DHODH
SCHEMBL2469709 0.82 CYP3A4 (0.40) EIF4E

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-2939540-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2939541-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 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
CN-102300459-A Herbicide-safener combination 2011-12-28 CN disclosed
EP-2369929-A2 HERBICIDE-SAFENER COMBINATION Bayer CropScience AG (DE) 2011-10-05 EP disclosed
WO-2010060581-A2 HERBICIDE-SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 WO disclosed
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP disclosed
CN-1245401-C 6-aryl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2006-03-15 CN disclosed
EP-1414814-B1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2005-02-02 EP disclosed
CN-1551876-A 6-aryl-4-aminopicolinates and their use as herbicides �ݶ�ũ�����޹�˾ 2004-12-01 CN disclosed
US-6784137-B2 SUCH AS 5,6-DICHLOROPYRIDINE-2-CARBOXYLIC ACID-N-OXIDE FOR PREEMERGENCE APPLICATION DOW AGROSCIENCES LLC 2004-08-31 US disclosed
US-20030114311-A1 6-Aryl-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2003-06-19 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 (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-20100137137-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 ATR 2098/4885ADORA2A 2644/4885ADORA1 3444/4885
US-20030114311-A1 6-Aryl-4-aminopicolinates and their use as herbicides AADAC, DDT, AADAT ATR 2425/4885ADORA2A 1162/4885ADORA1 1159/4885
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 ATR 2098/4885ADORA2A 2644/4885ADORA1 3444/4885

“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.