SCHEMBL7753073

SCHEMBL7753073

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPK10 P53779 1/20 0.36
PTK2B Q14289 1/20 0.36
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
NPC1 O15118 1/20 0.36
HIF1A Q16665 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL7752765 0.80 TSHR (0.38) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL11207345 0.77 AKR1C3 (0.49) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL7747800 0.76 ALDH1A1 (0.32) TSHRMEN1KMT2AALDH1A1MAPT
SCHEMBL7751834 0.76 ALDH1A1 (0.32) TSHRMEN1KMT2AALDH1A1MAPT
SCHEMBL3691371 0.76 RAB9A (0.47) KMT2AALDH1A1HSD17B10NPC1SMN1; SMN2
SCHEMBL9022614 0.76 MAPT (0.40) TSHRALDH1A1HSD17B10MAPTALOX15
SCHEMBL29883932 0.76 RAB9A (0.47) KMT2AALDH1A1HSD17B10NPC1SMN1; SMN2
SCHEMBL28365483 0.76 RAB9A (0.47) KMT2AALDH1A1HSD17B10NPC1SMN1; SMN2
SCHEMBL3688001 0.76 RAB9A (0.47) KMT2AALDH1A1HSD17B10NPC1SMN1; SMN2
SCHEMBL29883665 0.76 RAB9A (0.47) KMT2AALDH1A1HSD17B10NPC1SMN1; SMN2

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