SCHEMBL13488462

SCHEMBL13488462

CCCCOCC(O)CN(CCC)CCC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.52
HTT P42858 1/20 0.50
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 1/20 0.46
LPAR5 Q9H1C0 1/20 0.44
ALDH1A1 P00352 3/20 0.43
SPHK1 Q9NYA1 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
CASR P41180 1/20 0.37

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
SCHEMBL25839458 0.96 USP2 (0.52) USP2HTTKDM4ETDP1MAPK1
SCHEMBL27509723 0.93 USP2 (0.62) USP2HTTKDM4ETDP1MAPK1
SCHEMBL13609390 0.92 USP2 (0.52) USP2HTTKDM4ETDP1MAPK1
SCHEMBL22788472 0.90 USP2 (0.57) USP2HTTKDM4ETDP1MAPK1
SCHEMBL757371 0.89 USP2 (0.53) USP2HTTKDM4ETDP1MAPK1
SCHEMBL13299372 0.89 USP2 (0.52) USP2HTTKDM4ETDP1MAPK1
SCHEMBL22104297 0.89 USP2 (0.56) USP2HTTKDM4ETDP1MAPK1
SCHEMBL12761099 0.87 USP2 (0.47) USP2HTTKDM4ETDP1MAPK1
SCHEMBL13621239 0.86 USP2 (0.53) USP2HTTKDM4ETDP1MAPK1
SCHEMBL20228146 0.86 USP2 (0.53) USP2HTTKDM4ETDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8398961-B2 freshly ground, shaved or rasped only directly prior to use; wetted; used to style, construct and/or set the hairstyle; amount regulates whether the setting should be slight or range to strong setting; grinder HENKEL AG & CO. KGAA (DE) 2013-03-19 US disclosed
US-20100047202-A1 Hair-Conditioning Agents Containing Selected Cationic Polymers and Water-Soluble Silicones HENKEL AG & CO.KGAA (DE) 2010-02-25 US disclosed
US-20090076238-A1 Mono-or Poly-Quarternary Polysiloxanes MOMENTIVE PERFORMANCE MATERIALS INC. 2009-03-19 US disclosed
US-20090076238-A1 Mono-or Poly-Quarternary Polysiloxanes MOMENTIVE PERFORMANCE MATERIALS INC. 2009-03-19 US disclosed
US-20080274071-A1 POWDERY STYLING AGENTS AND THE DISPENSER SYSTEMS THEREOF HENKEL AG & CO. KGAA (DE) 2008-11-06 US disclosed
US-7217777-B2 Polymmonium-polysiloxane compounds, methods for the production and use thereof GE BAYER SILICONES GMBH & CO. KG (DE) 2007-05-15 US disclosed
US-7217777-B2 Polymmonium-polysiloxane compounds, methods for the production and use thereof GE BAYER SILICONES GMBH & CO. KG (DE) 2007-05-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080274071-A1 POWDERY STYLING AGENTS AND THE DISPENSER SYSTEMS THEREOF KRT18, PRKDC, PRKX USP2 2310/4885HTT 515/4885KDM4E 1224/4885
US-20100047202-A1 Hair-Conditioning Agents Containing Selected Cationic Polymers and Water-Soluble Silicones KRT18, CUTA, HDAC10 USP2 3685/4885HTT 974/4885KDM4E 1173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.