SCHEMBL257067

SCHEMBL257067

CCOc1ccc(NC(=O)N2CCOCC2)cc1CC

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.64
RAB9A P51151 5/20 0.58
ALDH1A1 P00352 4/20 0.58
BLM P54132 1/20 0.54
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
NPC1 O15118 4/20 0.53
GAA P10253 2/20 0.52
KDM4E B2RXH2 2/20 0.52
HPGD P15428 2/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
NPY5R Q15761 1/20 0.52
TP53 P04637 1/20 0.51
ESR2 Q92731 1/20 0.51
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL256091 0.89 L3MBTL1 (0.61) SMN1; SMN2RAB9AALDH1A1MEN1KMT2A
SCHEMBL256088 0.88 L3MBTL1 (0.60) SMN1; SMN2RAB9AALDH1A1MEN1KMT2A
SCHEMBL9967740 0.86 SMN1; SMN2 (0.61) SMN1; SMN2RAB9AALDH1A1BLMMEN1
SCHEMBL256087 0.83 MEN1 (0.59) SMN1; SMN2ALDH1A1MEN1KMT2AGAA
SCHEMBL10777343 0.77 TDP1 (0.55) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL5953095 0.76 TDP1 (0.70) RAB9AALDH1A1MEN1KMT2AGAA
SCHEMBL16638506 0.74 L3MBTL1 (0.59) SMN1; SMN2RAB9AALDH1A1MEN1KMT2A
SCHEMBL3687471 0.74 KDM4E (0.50) SMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL257065 0.73 TDP1 (0.60) ALDH1A1MEN1KMT2ANPC1KDM4E
SCHEMBL16638507 0.73 L3MBTL1 (0.57) SMN1; SMN2RAB9AALDH1A1MEN1KMT2A

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
WO-2012028578-A1 SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES BAYER CROPSCIENCE AG (DE) 2012-03-08 WO disclosed