SCHEMBL16005651

SCHEMBL16005651

CCCCC(N)(O)C(O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 12/20 0.44
SMPD1 P17405 4/20 0.37
GGPS1 O95749 6/20 0.34
CES2 O00748 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 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
SCHEMBL5694480 0.92 FDPS (0.46) FDPSSMPD1GGPS1CES2
SCHEMBL16005396 0.90 FDPS (0.48) FDPSSMPD1GGPS1CES2
SCHEMBL16005051 0.90 FDPS (0.48) FDPSSMPD1GGPS1CES2
SCHEMBL16005421 0.90 FDPS (0.48) FDPSSMPD1GGPS1CES2
SCHEMBL16005682 0.84 FDPS (0.41) FDPSSMPD1GGPS1CES2ESR1
SCHEMBL16005599 0.82 FDPS (0.40) FDPSSMPD1
SCHEMBL16005257 0.82 FDPS (0.40) FDPSSMPD1GGPS1
SCHEMBL11251499 0.79 FDPS (0.41) FDPSSMPD1GGPS1ESR1ESR2
SCHEMBL16005532 0.77 FDPS (0.43) FDPSSMPD1GGPS1CES2
SCHEMBL14840328 0.77 FDPS (0.48) FDPSSMPD1GGPS1ESR1ESR2

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-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP claimed
EP-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP disclosed