SCHEMBL28941504

SCHEMBL28941504

CCOC(=O)C(CC)C(=O)OCc1cnnc(OCOC)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.33
MAPK1 P28482 3/20 0.32
L3MBTL1 Q9Y468 3/20 0.32
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
HIF1A Q16665 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30

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
SCHEMBL27600842 0.80 GAA (0.36) TDP1MAPK1L3MBTL1TSHRALDH1A1
SCHEMBL27787098 0.67 NAMPT (0.50) L3MBTL1ALDH1A1KMT2A
SCHEMBL7060682 0.66 MMP8 (0.56) TDP1MAPK1L3MBTL1TSHRALDH1A1
SCHEMBL10962901 0.66 MEN1 (0.50) TDP1ALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL27522636 0.66 ALDH1A1 (0.48) TDP1ALDH1A1LMNAMEN1KMT2A
SCHEMBL27787137 0.66 LDHA (0.50) TDP1MAPK1L3MBTL1TSHRALDH1A1
SCHEMBL27374014 0.65 KMT2A (0.48) TDP1ALDH1A1LMNAMEN1KMT2A
SCHEMBL10964454 0.64 EPHX2 (0.47) TDP1MAPK1L3MBTL1TSHRALDH1A1
SCHEMBL27531556 0.64 KDM4E (0.46) TDP1MAPK1L3MBTL1ALDH1A1LMNA
SCHEMBL230068 0.64 ALDH1A1 (0.50) TDP1ALDH1A1LMNAMEN1KMT2A

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
CN-100357280-C Dihydronaphthalene devivatives and drugs contanining these compounds as active ingrdeient ONO PHARMACENTICAL CO LTD (JP) 2007-12-26 CN disclosed
CN-1489582-A Dihydronaphthalene devivatives and drugs contanining these compounds as active ingrdeient СҰҩƷ��ҵ��ʽ���� 2004-04-14 CN disclosed