SCHEMBL28798906

SCHEMBL28798906

O=C1CCCc2oc3ccc(F)cc3c(=O)c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.59
PIM3 Q86V86 1/20 0.59
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.44
GABRP O00591 6/20 0.44
GABRD O14764 6/20 0.44
GABRA1 P14867 6/20 0.44
GABRB1 P18505 6/20 0.44
GABRG2 P18507 6/20 0.44
GABRB3 P28472 6/20 0.44
GABRA5 P31644 6/20 0.44
GABRA3 P34903 6/20 0.44
GABRA2 P47869 6/20 0.44
GABRB2 P47870 6/20 0.44
GABRA4 P48169 6/20 0.44
GABRE P78334 6/20 0.44
GABRA6 Q16445 6/20 0.44
GABRG1 Q8N1C3 6/20 0.44
GABRG3 Q99928 6/20 0.44

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
SCHEMBL28798870 0.84 PIM1 (0.54) PIM1PIM3LMNAGABRPGABRD
SCHEMBL28798897 0.84 PIM1 (0.54) PIM1PIM3KMT2ALMNAGABRP
SCHEMBL28798900 0.84 PIM1 (0.54) PIM1PIM3MEN1KMT2ALMNA
SCHEMBL28798818 0.80 ALDH1A1 (0.59) PIM1PIM3MEN1KMT2ALMNA
SCHEMBL28798875 0.80 PIM1 (0.61) PIM1PIM3LMNAALDH1A1SMN1; SMN2
SCHEMBL14334925 0.80 PIM1 (0.59) PIM1PIM3MEN1KMT2ALMNA
SCHEMBL23537467 0.79 PIM1 (0.49) PIM1PIM3KMT2ALMNAGABRP
SCHEMBL30023697 0.79 PIM1 (0.49) PIM1PIM3KMT2ALMNAGABRP
SCHEMBL28798820 0.75 PIM1 (0.65) PIM1PIM3KMT2ALMNAALDH1A1
SCHEMBL28798847 0.75 PIM1 (0.65) PIM1PIM3KMT2ALMNAALDH1A1

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
CN-114539200-A Synthesis method of tetrahydroxanthone 陕西科技大学 2022-05-27 CN disclosed