SCHEMBL11534388

SCHEMBL11534388

Cc1cc(C)n(C)c(=O)c1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 6/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 4/20 0.34
ERN1 O75460 2/20 0.34
GAA P10253 1/20 0.34
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
USP2 O75604 1/20 0.33
NQO2 P16083 1/20 0.32
RECQL P46063 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
BRD4 O60885 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL4393645 0.73 KDM4E (0.44) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL10972522 0.71 ALDH1A1 (0.34) KDM4EL3MBTL1MAPTALDH1A1GAA
Hydrochloric Acid SCHEMBL5487003 0.71 KDM4E (0.43) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL17980826 0.70 KDM4E (0.42) KDM4EL3MBTL1MAPTMEN1KMT2A
SCHEMBL21977695 0.70 KDM4E (0.42) KDM4EL3MBTL1MAPTMEN1KMT2A
SCHEMBL21955382 0.70 KDM4E (0.42) KDM4EL3MBTL1MAPTMEN1KMT2A
SCHEMBL11526426 0.70 KDM4E (0.42) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL22017507 0.67 KDM4E (0.40) KDM4EL3MBTL1ALDH1A1USP2HPGD
SCHEMBL22016779 0.67 KDM4E (0.40) KDM4EL3MBTL1MAPTKMT2AALDH1A1
SCHEMBL28279267 0.67 ADORA2B (0.36) KDM4EMAPTMEN1KMT2AALDH1A1

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
US-4159202-A PHOTOCOPYING HOECHST AKTIENGESELLSCHAFT (DE) 1979-06-26 US disclosed