SCHEMBL3077346

SCHEMBL3077346

O=C(O)Oc1ccc(C(F)(F)F)[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HSD17B2 P37059 19/20 0.40
▸ HSD17B1 P14061 2/20 0.36

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
SCHEMBL3082984 0.87 HSD17B2 (0.32) HSD17B2
SCHEMBL3083394 0.84 ELANE (0.30) —
SCHEMBL3088157 0.82 HSD17B2 (0.48) HSD17B2HSD17B1
SCHEMBL3077344 0.73 HSD17B2 (0.52) HSD17B2HSD17B1
SCHEMBL3071416 0.72 HSD17B2 (0.34) HSD17B2HSD17B1
SCHEMBL4667450 0.70 HSD17B2 (0.38) HSD17B2HSD17B1
SCHEMBL16612801 0.69 HSD17B2 (0.38) HSD17B2HSD17B1
SCHEMBL17844662 0.69 KDM4E (0.57) —
SCHEMBL16372116 0.69 HSD17B1 (0.43) HSD17B2HSD17B1
SCHEMBL16612938 0.68 HSD17B2 (0.37) HSD17B2HSD17B1

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
EP-2144879-B1 PYRIDON CARBOXAMIDES, AGENTS CONTAINING THESE BUT NOT IMPACTING USEFUL PLANTS AND METHOD FOR THEIR MANUFACTURE AND APPLICATION BAYER IP GMBH (DE) 2015-04-08 — — EP disclosed
EP-2144879-A2 PYRIDONECARBOXAMIDES CROP PROTECTION AGENTS CONTAINING THE SAME METHOD FOR PRODUCTION AND USE THEREOF Bayer CropScience AG (DE) 2010-01-20 — — EP disclosed
WO-2008131860-A2 PYRIDONECARBOXAMIDES CROP PROTECTION AGENTS CONTAINING THE SAME METHOD FOR PRODUCTION AND USE THEREOF BAYER CROPSCIENCE AG (DE) 2008-11-06 — — WO disclosed
EP-1987717-A1 Pyridon carboxamides, agents containing these but not impacting useful plants and method for their manufacture and application Bayer CropScience AG (DE) 2008-11-05 — — EP disclosed
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