SCHEMBL3280642

SCHEMBL3280642

C=C(C)C(=O)NCCCN(CCCCC)CCCCC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.42
EPHX1 P07099 6/20 0.41
KDM5A P29375 3/20 0.40
PHF8 Q9UPP1 2/20 0.40
KDM4C Q9H3R0 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
NAAA Q02083 1/20 0.40
PLA2G2A P14555 1/20 0.39
PLA2G4A P47712 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CASP2 P42575 1/20 0.38
ACHE P22303 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL292986 0.98 DNM1 (0.45) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL291199 0.98 DNM1 (0.45) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL3285678 0.97 EPHX1 (0.46) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL3280795 0.95 EPHX1 (0.48) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL135640 0.95 DNM1 (0.40) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL291266 0.93 KDM5A (0.41) EPHX1KDM5APHF8KDM4CZDHHC20
SCHEMBL3279442 0.93 DNM1 (0.40) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL292513 0.92 DNM1 (0.42) DNM1EPHX1KDM5APHF8KDM4C
SCHEMBL182532 0.91 DRD2 (0.41) DNM1ALDH1A1ACHEDRD2DRD4
SCHEMBL16908423 0.91 KDM4E (0.41) DNM1ALDH1A1DRD2DRD4DRD3

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-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US claimed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US claimed
US-5830447-A BLEND OF COPOLYMER AND VOLATILE, HYDROPHOBIC SOLVENT THE PROCTER & GAMBLE COMPANY (US) 1998-11-03 US claimed
CN-111432779-A Cosmetic composition for immediate wrinkle improvement and elasticity enhancement 株式会社LG生活健康 2020-07-17 CN disclosed
US-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US disclosed