SCHEMBL2903544

SCHEMBL2903544

O=C(O)CC1CCCC=CO1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MIF P14174 1/20 0.30

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
SCHEMBL11636230 0.89 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C9CYP2C19MIF
SCHEMBL11763289 0.84
SCHEMBL14304546 0.76
SCHEMBL11638619 0.72 MIF (0.30) MIF
SCHEMBL9251598 0.67 CHRNB2 (0.40)
SCHEMBL3779368 0.67 SLC6A1 (0.39)
SCHEMBL3779370 0.67 SLC6A1 (0.39)
SCHEMBL6077803 0.67 CHRNB2 (0.40)
SCHEMBL3426708 0.67 PTGIR (0.35)
SCHEMBL1698570 0.66

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-1771492-B1 STIMULATEABLE POLYMER PARTICLES EXHIBITING REACTIVE FUNCTIONS, METHOD FOR THE PRODUCTION AND THE USE THEREOF CENTRE NAT RECH SCIENT (FR) 2010-11-10 EP claimed
EP-1758621-B1 BIOACTIVE BIOMATERIALS FOR CONTROLLED DELIVERY OF ACTIVE PRINCIPLES CENTRE NAT RECH SCIENT (FR) 2010-08-11 EP claimed