SCHEMBL7752186

SCHEMBL7752186

CCO/C(=N/Oc1ncccc1C(F)(F)F)c1ccccc1/C(=N\OC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
DHODH Q02127 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CTNNB1 P35222 1/20 0.34
WNT3A P56704 1/20 0.34
ALDH1A1 P00352 4/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
RBP4 P02753 1/20 0.34
TTR P02766 1/20 0.34
P2RY1 P47900 1/20 0.34
SSTR4 P31391 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL7752188 0.76 HIF1A (0.39) CTNNB1WNT3ARBP4TTRSSTR4
SCHEMBL7753073 0.74 TSHR (0.42) ALDH1A1HTTMAPT
SCHEMBL7752765 0.73 TSHR (0.38) ALDH1A1MAPT
SCHEMBL8368536 0.69 P2RY1 (0.42) ALDH1A1MAPTRBP4TTRP2RY1
SCHEMBL8368534 0.69 P2RY1 (0.42) ALDH1A1MAPTRBP4TTRP2RY1
SCHEMBL8370620 0.69 HIF1A (0.46) SSTR4SLC22A12
SCHEMBL8370616 0.69 HIF1A (0.46) SSTR4SLC22A12
SCHEMBL8022654 0.69 P2RX7 (0.47) L3MBTL1ALDH1A1HTTMAPTTDP1
SCHEMBL7751835 0.68 PRNP (0.34) L3MBTL1ALDH1A1MAPT
SCHEMBL10667514 0.68 CTNNB1 (0.54) L3MBTL1CTNNB1WNT3AALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1070052-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 2001-01-24 EP disclosed
WO-1999051579-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 1999-10-14 WO disclosed