SCHEMBL9104953

SCHEMBL9104953

CCOC(=O)NC1(CC)C=CC=CC1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.33
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 4/20 0.33
RECQL P46063 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
LMNA P02545 3/20 0.33
APEX1 P27695 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
POLB P06746 3/20 0.31
GLA P06280 1/20 0.31
ALOX15 P16050 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL22410460 0.79
SCHEMBL668278 0.69
SCHEMBL15012548 0.69 TSHR (0.34) GAAALDH1A1KDM4EALOX15KMT2A
SCHEMBL1986795 0.68
SCHEMBL11482827 0.68 ALPG (0.32) GAAALDH1A1KDM4EMAPTRECQL
SCHEMBL1989127 0.67
SCHEMBL4408140 0.67 PPID (0.30) GAA
SCHEMBL39621 0.66
SCHEMBL7569651 0.66
SCHEMBL7416135 0.66

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
EP-2239257-B1 NOVEL QUINAZOLINE-2,4-DIONE DERIVATIVE, AND MEDICAL COMPOSITIONS FOR THE PROPHYLAXIS AND TREATMENT OF CRANIAL NERVE DISEASE CONTAINING THE SAME SHIN POONG PHARMACEUTICAL CO LTD (KR) 2012-06-06 EP claimed