SCHEMBL9564356

SCHEMBL9564356

CCN/C(=C\C(=O)c1c(F)cccc1Cl)SC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
GAA P10253 7/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
HPGD P15428 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ITGB2 P05107 1/20 0.40
ICAM1 P05362 1/20 0.40
ITGAL P20701 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38

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
SCHEMBL5022118 0.76 HPGD (0.59) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL10874394 0.72 MAPT (0.48) KDM4EGAARAB9AMAPTHPGD
SCHEMBL3305713 0.70 GAA (0.44) GAARAB9AMAPTNPSR1JAK2
SCHEMBL3305720 0.70 GAA (0.44) GAARAB9AMAPTNPSR1JAK2
SCHEMBL3311251 0.70 GAA (0.46) GAARAB9AMAPTNPSR1JAK2
SCHEMBL3311255 0.70 GAA (0.46) GAARAB9AMAPTNPSR1JAK2
SCHEMBL3311258 0.70 GAA (0.46) GAARAB9AMAPTNPSR1JAK2
SCHEMBL18359173 0.68 HPGD (0.57) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL6462215 0.68 MEN1 (0.56) GAARAB9AMAPTNPSR1JAK2
SCHEMBL9564391 0.68 ALDH1A1 (0.44) GAARAB9AMAPTHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0563686-A1 Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation BAYER AG (DE) 1993-10-06 EP disclosed