SCHEMBL9577486

SCHEMBL9577486

COc1cc(N2C(=O)OC(=C(C)C)C2=O)c(F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPOX P50336 7/20 0.51
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HSP90AA1 P07900 1/20 0.42
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
CCR6 P51684 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
LMNA P02545 2/20 0.34
TP53 P04637 2/20 0.34
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL9620060 0.88 CUL4A (0.43) PPOXALDH1A1MAPTRAB9ANPSR1
SCHEMBL9577463 0.87 PPOX (0.47) PPOXALDH1A1MAPTNPSR1TSHR
SCHEMBL9577505 0.84 PPOX (0.42) PPOXALDH1A1PKMKDM4E
SCHEMBL7932830 0.83 PPOX (0.32) PPOXMAPTPOLBKMT2A
SCHEMBL9577496 0.83 PPOX (0.38) PPOXLMNA
SCHEMBL9577438 0.83 PPOX (0.50) PPOXTSHR
SCHEMBL7936557 0.83 ALDH1A1 (0.38) PPOXALDH1A1
Pentoxazone SCHEMBL38904 0.83 PPOX (0.51) PPOX
SCHEMBL7592035 0.82 PPOX (0.39) PPOX
SCHEMBL9775325 0.80 PPOX (0.61) PPOXALDH1A1MAPTNPSR1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0350880-B1 HERBICIDAL COMPOSITION AND HERBICIDAL METHOD Kaken Pharmaceutical Co., Ltd. (JP) 1993-04-07 EP disclosed
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-5024692-A Oxazolidinedione and phosphorus containing amino acid mixture KAKEN PHARMACEUTICAL CO., LTD. (JP) 1991-06-18 US disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
EP-0350880-A2 Herbicidal composition and herbicidal method Kaken Pharmaceutical Co., Ltd. (JP) 1990-01-17 EP disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed