SCHEMBL9901365

SCHEMBL9901365

C#CCOc1ccc(C=CC(O)=CC(C)=O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.60
HDAC1 Q13547 2/20 0.59
HDAC2 Q92769 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
APP P05067 2/20 0.55
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SNCA P37840 1/20 0.52
NFE2L2 Q16236 1/20 0.51
MAPT P10636 3/20 0.51
LMNA P02545 3/20 0.51
PTGES O14684 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
NPC1 O15118 1/20 0.50

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
SCHEMBL9901363 1.00 FDPS (0.60) FDPSHDAC1HDAC2HDAC8APP
SCHEMBL9901361 1.00 FDPS (0.60) FDPSHDAC1HDAC2HDAC8APP
SCHEMBL9947558 0.91 HDAC1 (0.72) FDPSHDAC1HDAC2HDAC8KDM4E
SCHEMBL19695927 0.90 FDPS (0.73) FDPSAPPKDM4EALDH1A1SMN1; SMN2
SCHEMBL30289943 0.88 KDM4E (0.69) FDPSHDAC1HDAC2HDAC8KDM4E
SCHEMBL21715528 0.88 KDM4E (0.69) FDPSHDAC1HDAC2HDAC8KDM4E
SCHEMBL20455920 0.88 KDM4E (0.69) FDPSHDAC1HDAC2HDAC8KDM4E
SCHEMBL9947551 0.87 HDAC1 (0.61) FDPSHDAC1HDAC2HDAC8APP
SCHEMBL31682437 0.85 HDAC1 (0.65) HDAC1HDAC2HDAC8APPKDM4E
SCHEMBL15020459 0.85 HDAC1 (0.65) HDAC1HDAC2HDAC8APPKDM4E

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
WO-2012076696-A1 NEW METAL CARBONYL COMPLEXES OF CURCUMIN DERIVATIVES, THEIR SYNTHESIS AND THEIR USES IN THERAPEUTIC APPLICATION UNIVERSITE PIERRE ET MARIE CURIE (PARIS 6) (FR) 2012-06-14 WO disclosed