SCHEMBL9835946

SCHEMBL9835946

C=C(C)C(OC(=O)Nc1c(F)cc(F)cc1F)C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.33
FUCA1 P04066 1/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL9836230 0.83 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2
SCHEMBL27522368 0.80 MAPT (0.46) KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9835566 0.79 ALDH1A1 (0.44) KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9836182 0.78 ALDH1A1 (0.39) NLRP3KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9837242 0.77 KDM4E (0.48) KMT2ASMN1; SMN2MEN1
SCHEMBL9837145 0.77 KMT2A (0.52) KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9836291 0.76 KMT2A (0.44) KMT2AALDH1A1SMN1; SMN2
SCHEMBL9834855 0.76 HPGD (0.35) KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9835593 0.76 NPSR1 (0.47) KMT2AALDH1A1MEN1
SCHEMBL9833989 0.76 RXFP1 (0.41) KMT2AALDH1A1SMN1; SMN2MEN1

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-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US 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