SCHEMBL8914700

SCHEMBL8914700

Cc1c(OC(=O)c2c3ccccc3nc3ccccc23)ccc(C(=O)ON2C(=O)CCC2=O)c1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PDE10A Q9Y233 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 3/20 0.36
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10578481 0.85 MAPT (0.39) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL3143334 0.81 KDM4E (0.44) MAPTPDE10AMEN1KMT2AALDH1A1
SCHEMBL8876118 0.81 PDE10A (0.44) MAPTNPSR1PDE10AMEN1KMT2A
SCHEMBL7118784 0.80 KDM4E (0.40) MAPTNPSR1PDE10AMEN1KMT2A
SCHEMBL30659834 0.78 MAPT (0.40) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL10578489 0.77 KMT2A (0.48) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL7533773 0.75 LMNA (0.38) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL8411907 0.73 KMT2A (0.40) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL8875098 0.71 TP53 (0.46) MAPTNPSR1PDE10AMEN1KMT2A
SCHEMBL28811993 0.70 KDM4E (0.40) MAPTNPSR1MEN1KMT2AALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0298708-A2 Method for determining thyroxine uptake Ciba Corning Diagnostics Corp. (US) 1989-01-11 EP claimed
EP-0754178-A1 NOVEL FUNCTIONALIZED HYDROPHILIC ACRIDINIUM ESTERS Ciba Corning Diagnostics Corp. (US) 1997-01-22 EP disclosed
WO-1995027702-A1 NOVEL FUNCTIONALIZED HYDROPHILIC ACRIDINIUM ESTERS CIBA CORNING DIAGNOSTICS CORP. (US) 1995-10-19 WO disclosed