SCHEMBL3867705

SCHEMBL3867705

O=C1CCCCCN1C1CCCN1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
HRH3 Q9Y5N1 1/20 0.33
KDM4E B2RXH2 2/20 0.32
POLB P06746 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CYP2D6 P10635 1/20 0.30
HRH1 P35367 1/20 0.30
MGLL Q99685 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
SCHEMBL14060967 0.81 MGLL (0.39) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL2405637 0.73 FKBP5 (0.46) GAAALDH1A1HSD17B10HPGDKDM4E
SCHEMBL2853069 0.73 HTR2C (0.43) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL24710914 0.72 HTR6 (0.41)
SCHEMBL8441416 0.72 HRH3 (0.31) HRH3
SCHEMBL23002161 0.72 ALDH1A1 (0.33) GAAALDH1A1HSD17B10HPGD
SCHEMBL29145763 0.72 HTR6 (0.41)
SCHEMBL6799429 0.71 HTR2C (0.33)
Hydrochloric Acid SCHEMBL21597931 0.71 HTR2C (0.42) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL10427141 0.71 NOS3 (0.42) GAAPOLBDPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020234535-A1 DEHYDRATED COATING COMPOSITION IN SOLID FORM, METHOD OF OBTAINING SAME, AND METHOD FOR REHYDRATING SAME NOF METAL COATINGS EUROPE (FR) 2020-11-26 WO disclosed
EP-2039346-A1 Cosmetic composition comprising a cationic copolymer and a starch and cosmetic treatment process L'Oréal (FR) 2009-03-25 EP disclosed
EP-2039345-A1 Cosmetic compositions containing a cationic copolymer and a particular triglyceride and uses thereof L'Oréal (FR) 2009-03-25 EP disclosed
EP-2039344-A2 Cosmetic composition comprising a cationic copolymer and an anionic associative polymer and cosmetic treatment process L'Oréal (FR) 2009-03-25 EP disclosed