SCHEMBL6569665

SCHEMBL6569665

CC=CC(=O)NCC(C)CCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.40
CNR1 P21554 4/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 2/20 0.40
USP2 O75604 1/20 0.33
FAAH O00519 1/20 0.33
GFPT1 Q06210 1/20 0.31
UTS2R Q9UKP6 2/20 0.31
HPGD P15428 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL20586103 0.82 CNR2 (0.49) CNR2CNR1PPARGPPARDPPARA
SCHEMBL7175257 0.81 TSHR (0.45) USP2KDM4EALDH1A1
SCHEMBL7211760 0.76 UTS2R (0.37) UTS2RSMN1; SMN2ALDH1A1CHRNB2CHRNB4
SCHEMBL108355 0.74 DNM1 (0.42) USP2HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL11436694 0.74 DNM1 (0.42) USP2HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL11434848 0.74 CNR2 (0.62) CNR2CNR1PPARGPPARDPPARA
SCHEMBL11466468 0.74 CNR2 (0.62) CNR2CNR1PPARGPPARDPPARA
SCHEMBL6138646 0.74 CNR2 (0.42) CNR2CNR1PPARGPPARDPPARA
SCHEMBL8648273 0.72 CNR2 (0.47) CNR2CNR1PPARGPPARDPPARA
SCHEMBL7772177 0.72 CNR2 (0.47) CNR2CNR1PPARGPPARDPPARA

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-1407297-A1 BIOMEDICAL MOLDING MATERIALS FROM SEMI-SOLID PRECURSORS ZMS, LLC (US) 2004-04-14 EP disclosed
WO-2003003073-A1 BIOMEDICAL MOLDING MATERIALS FROM SEMI-SOLID PRECURSORS ZMS, LLC (US) 2003-01-09 WO disclosed