SCHEMBL2802696

SCHEMBL2802696

C=C(C)C(=O)NCCCC(C)N(CC)CC

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
ALDH1A1 P00352 2/20 0.31
TGFBR1 P36897 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA4 P43681 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
EPHX1 P07099 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
SCHEMBL11278512 0.95 DPP7 (0.35) CCR2CYP1A2CYP2C9CYP2C19DPP7
SCHEMBL6845595 0.90 CHRNB2 (0.40) TGFBR1CHRNB2CHRNB4CHRNA4
SCHEMBL25911307 0.83 KDM4E (0.48) CCR2DPP7ALDH1A1CHRNB2CHRNB4
Fluoride SCHEMBL8583071 0.82 CHRNB2 (0.46) CYP1A2CYP2C9CYP2C19ALDH1A1TGFBR1
SCHEMBL2467198 0.80 TGFBR1 (0.34) TGFBR1
SCHEMBL25557372 0.79 ANPEP (0.41) CYP1A2CYP2C9CYP2C19DPP7ALDH1A1
SCHEMBL28730797 0.79 MEN1 (0.38) CCR2ALDH1A1CHRNB2CHRNB4CHRNA4
SCHEMBL11283812 0.77 CHRNB2 (0.45) DPP7CHRNB2CHRNB4CHRNA4KDM4E
SCHEMBL28346305 0.75 KDM4E (0.37) CYP1A2CYP2C9CYP2C19DPP7ALDH1A1
SCHEMBL6800579 0.75 DPP7 (0.35) CYP1A2CYP2C9CYP2C19DPP7TGFBR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8413719-B2 Relative permeability modification SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2013-04-09 US claimed
US-20100230106-A1 Relative Permeability Modification SCHLUMBERGER TECHNOLOGY CORPORATION 2010-09-16 US claimed
WO-2010103421-A1 RELATIVE PERMEABILITY MODIFICATION SCHLUMBERGER CANADA LIMITED (CA) 2010-09-16 WO claimed
US-8413719-B2 Relative permeability modification SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2013-04-09 US disclosed
US-20100230106-A1 Relative Permeability Modification SCHLUMBERGER TECHNOLOGY CORPORATION 2010-09-16 US disclosed
WO-2010103421-A1 RELATIVE PERMEABILITY MODIFICATION SCHLUMBERGER CANADA LIMITED (CA) 2010-09-16 WO disclosed