SCHEMBL7632804

SCHEMBL7632804

C=CCOc1ccc2c(CC)cc(=O)oc2c1C(=O)C=Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.61
ALDH1A1 P00352 8/20 0.61
MAPT P10636 8/20 0.61
HPGD P15428 5/20 0.61
LMNA P02545 3/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 2/20 0.43
SRC P12931 1/20 0.43
PLIN1 O60240 1/20 0.43
RAB9A P51151 1/20 0.43
PLIN5 Q00G26 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ABHD5 Q8WTS1 1/20 0.43
POLB P06746 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
FLT3 P36888 1/20 0.41
SLC5A1 P13866 1/20 0.41

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
SCHEMBL6903392 0.89 MAPT (0.56) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL7070719 0.80 CA12 (0.46) KDM4EALDH1A1MAPTKMT2ARAB9A
SCHEMBL6901231 0.80 MAPT (0.56) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL7070595 0.79 MAOB (0.40) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL7173515 0.79 MAPT (0.58) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL6903967 0.79 MAPT (0.51) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL6898972 0.79 KDM4E (0.57) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL6901805 0.77 KDM4E (0.60) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL11309411 0.77 KDM4E (1.00) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL7177555 0.76 MAPT (0.48) KDM4EALDH1A1MAPTHPGDLMNA

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
EP-1212311-A1 CHALCONE COUMARINS INDENA S.p.A. (IT) 2002-06-12 EP disclosed
WO-2001017984-A1 CHALCONE COUMARINS INDENA S.P.A. (IT) 2001-03-15 WO disclosed