SCHEMBL9838239

SCHEMBL9838239

CCOC(=O)c1coc(=O)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.48
TSHR P16473 2/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 3/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 3/20 0.42
MAPK1 P28482 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 2/20 0.41

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
SCHEMBL9839580 0.85 MAOB (0.51) MAOBTSHRALDH1A1MAPTLMNA
SCHEMBL9838198 0.81 BAZ2B (0.54) MAOBTSHRALDH1A1MAPTLMNA
SCHEMBL9838252 0.79 MAOB (0.47) MAOBTSHRALDH1A1MAPTLMNA
SCHEMBL9839489 0.77 MAOB (0.45) MAOBTSHRALDH1A1MAPTLMNA
SCHEMBL9840246 0.76 KDM4E (0.46) MAOBTSHRALDH1A1MAPTLMNA
SCHEMBL364335 0.75 TSHR (0.53) TSHRALDH1A1MAPTLMNAL3MBTL1
SCHEMBL10524528 0.75 KMT2A (0.42) MAOBALDH1A1MAPTLMNAL3MBTL1
SCHEMBL12326552 0.75 MAOB (0.56) MAOBALDH1A1MAPTKDM4EKMT2A
SCHEMBL7222675 0.75 TSHR (0.53) TSHRALDH1A1MAPTLMNAL3MBTL1
SCHEMBL31278130 0.73 MAOB (0.47) MAOBTSHRALDH1A1MAPTLMNA

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
US-5011944-A Substituted α-pyrones CIBA-GEIGY CORPORATION (US) 1991-04-30 US disclosed