SCHEMBL8560870

SCHEMBL8560870

O=C1OC(=O)c2nc(F)ccc21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TYMS P04818 4/20 0.39
ALDH1A1 P00352 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
SCHEMBL30442162 0.75 S100A4 (0.52) ALOX15TDP1TYMSALDH1A1
SCHEMBL261649 0.75 S100A4 (0.52) ALOX15TDP1TYMSALDH1A1
SCHEMBL8659590 0.75 NSD2 (0.41) ALOX15TDP1TYMSALDH1A1
SCHEMBL26732582 0.75 ALOX15 (0.41) ALOX15TDP1TYMSALDH1A1
SCHEMBL30450925 0.75 ALOX15 (0.41) ALOX15TDP1TYMSALDH1A1
SCHEMBL9589827 0.73 CYP3A4 (0.41) ALOX15TDP1TYMSALDH1A1
SCHEMBL9590364 0.72 ALOX15 (0.34) ALOX15TDP1TYMSALDH1A1
SCHEMBL24834521 0.71 ALOX15 (0.37) ALOX15TDP1TYMSALDH1A1
SCHEMBL10473024 0.71 RAB9A (0.43) ALOX15TDP1ALDH1A1
SCHEMBL10473824 0.71 ALOX15 (0.37) ALOX15TDP1TYMSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840904-A Fluoro-pyridine-2,3-dicarboxylic anhydrides which are intermediates for herbicidal pyridine-2,3-dicarboximides BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US claimed
EP-0661282-B1 Pyridine-2,3-dicarboxylic imides, process for their preparation and their use to control the growth of unwanted plants BASF AG (DE) 1998-04-22 EP claimed
US-5840904-A Fluoro-pyridine-2,3-dicarboxylic anhydrides which are intermediates for herbicidal pyridine-2,3-dicarboximides BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
US-5679622-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-21 US disclosed