SCHEMBL13413673

SCHEMBL13413673

COCCNC(=O)OCCn1c(=O)n(CCOC(=O)NCCOC)c(=O)n(CCOC(=O)NCCOC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
ACHE P22303 8/20 0.41
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL13413678 0.91 SMN1; SMN2 (0.40) MEN1KMT2ATDP1ACHEHPGD
SCHEMBL13413710 0.87 ACHE (0.44) MEN1KMT2ATDP1ACHEHPGD
SCHEMBL13413674 0.84 ACHE (0.42) ACHESMN1; SMN2
SCHEMBL13413672 0.83 CHRNB2 (0.45) ACHESMN1; SMN2ALDH1A1
SCHEMBL13413675 0.81 CREBBP (0.47) MEN1KMT2AACHEKDM4EALDH1A1
SCHEMBL13413676 0.81 ACHE (0.42) MEN1KMT2AACHESMN1; SMN2ALDH1A1
SCHEMBL14031944 0.80 ACHE (0.42) ACHE
SCHEMBL13309619 0.80 THRB (0.38) TDP1ACHESMN1; SMN2HTTALDH1A1
SCHEMBL13413693 0.80 CHRNB2 (0.43) ACHESMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL13413692 0.80 CHRNB2 (0.43) ACHESMN1; SMN2KDM4EALDH1A1GLA

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
US-20100071574-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-20100071574-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed