SCHEMBL11519212

SCHEMBL11519212

CCCC(N)(CCC)CC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 18/20 0.61
GGPS1 O95749 6/20 0.50
PDE3A Q14432 2/20 0.45
LMNA P02545 1/20 0.45
ADRB3 P13945 1/20 0.45
PDE4D Q08499 1/20 0.45
SMPD1 P17405 2/20 0.42

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
SCHEMBL594692 0.77 FDPS (1.00) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL7954088 0.73 FDPS (0.48) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL24616672 0.71 FDPS (0.52) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL30487876 0.71 FDPS (0.38) FDPS
SCHEMBL11797302 0.70 FDPS (0.65) FDPSGGPS1SMPD1
SCHEMBL4100418 0.70 FDPS (1.00) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL11551689 0.70 FDPS (0.82) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL12541428 0.69 FDPS (0.65) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL5918828 0.69 FDPS (0.62) FDPSGGPS1SMPD1
SCHEMBL4093004 0.69 FDPS (0.86) FDPSGGPS1PDE3ALMNAADRB3

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-4138478-A Agents for reducing the damage to hair during bleaching and dyeing HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1979-02-06 US disclosed