SCHEMBL9840246

SCHEMBL9840246

CCCCc1cc(=O)occ1C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
NOD2 Q9HC29 1/20 0.46
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAOB P27338 1/20 0.44
ALDH1A1 P00352 7/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 5/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 2/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 3/20 0.39
MAPK1 P28482 2/20 0.38
MEN1 O00255 2/20 0.38
ERAP1 Q9NZ08 1/20 0.38
HPGD P15428 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
SCHEMBL9839580 0.80 MAOB (0.51) KDM4EMAPTMAOBALDH1A1LMNA
SCHEMBL10521778 0.78 KDM4E (0.40) KDM4EMAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL9838239 0.76 MAOB (0.48) KDM4EMAPTMAOBALDH1A1LMNA
SCHEMBL9838198 0.76 BAZ2B (0.54) KDM4EMAPTMAOBALDH1A1LMNA
SCHEMBL9838252 0.75 MAOB (0.47) KDM4EMAPTMAOBALDH1A1LMNA
SCHEMBL28537883 0.74 CA12 (0.62) KDM4ENOD2MAPTSMN1; SMN2MAOB
SCHEMBL9839489 0.72 MAOB (0.45) KDM4EMAPTMAOBALDH1A1LMNA
SCHEMBL9307300 0.72 LMNA (0.49) KDM4ENOD2MAPTSMN1; SMN2ALDH1A1
SCHEMBL1791133 0.71 TSHR (0.65) KDM4EALDH1A1LMNAL3MBTL1POLB
SCHEMBL9590339 0.71 KMT2A (0.46) KDM4ENOD2MAPTALDH1A1LMNA

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