SCHEMBL3356779

SCHEMBL3356779

Oc1cccc(C2CCCCCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.59
HDAC2 Q92769 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
KMO O15229 1/20 0.58
DRD2 P14416 3/20 0.54
SIGMAR1 Q99720 3/20 0.54
DRD4 P21917 2/20 0.54
DRD3 P35462 2/20 0.54
NFKB1 P19838 1/20 0.54
PRCP P42785 1/20 0.54
EBP Q15125 1/20 0.54

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
SCHEMBL4959143 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL4962000 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL4961955 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL5272910 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL31123519 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL1982025 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL219530 1.00 HDAC4 (0.59) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL28703324 0.98 HDAC4 (0.58) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL1661863 0.98 HDAC4 (0.61) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL1658753 0.94 HDAC4 (0.56) HDAC4HDAC2HDAC8DRD2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015013456-A1 INDICATOR COMPOUNDS, POLYMERIZABLE DERIVATIVES THEREOF AND INFECTION INDICATING MEDICAL DEVICES COMPRISING THE SAME INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2015-01-29 WO disclosed
EP-1871844-B1 BUBBLE COMPOSITION WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2014-08-27 EP disclosed
US-20100209810-A1 POLYMER ELECTROLYTE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 US disclosed
EP-2192597-A1 POLYMER ELECTROLYTE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2010-06-02 EP disclosed
EP-1871844-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C Technologies LLC (US) 2008-01-02 EP disclosed
WO-2007008389-A2 USE OF COLOR CHANGING INDICATORS IN CONSUMER PRODUCTS C2C TECHNOLOGIES LLC (US) 2007-01-18 WO disclosed
US-20070010400-A1 Use of color changing indicators in consumer products C2C TECHNOLOGIES, LLC 2007-01-11 US disclosed
US-20060257439-A1 Cleansing compositions with color changing indicator CRAYOLA LLC 2006-11-16 US disclosed
US-20060236470-A1 Novelty compositions with color changing indicator CRAYOLA LLC 2006-10-26 US disclosed
WO-2006105193-A2 PERSONAL CARE COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105260-A1 ORAL CARE COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105261-A1 CLEANSING COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105191-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
US-20060222675-A1 Personal care compositions with color changing indicator C2C TECHNOLOGIES, LLC 2006-10-05 US disclosed
US-20060222601-A1 Oral care compositions with color changing indicator C2C TECHNOLOGIES, LLC 2006-10-05 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 (5 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-20060222675-A1 Personal care compositions with color changing indicator CUTA, POLR1C, TYR HDAC4 1806/4885HDAC2 605/4885HDAC8 2052/4885
US-20060257439-A1 Cleansing compositions with color changing indicator WASHC5, WASHC4, FHIT HDAC4 3947/4885HDAC2 4226/4885HDAC8 3601/4885
US-20060222601-A1 Oral care compositions with color changing indicator CA9, CA7, TAS2R7 HDAC4 558/4885HDAC2 451/4885HDAC8 838/4885
US-20070010400-A1 Use of color changing indicators in consumer products NQO2, CA4, CA7 HDAC4 559/4885HDAC2 1311/4885HDAC8 1409/4885
US-20060236470-A1 Novelty compositions with color changing indicator MITF, CRABP2, SHH HDAC4 1817/4885HDAC2 2140/4885HDAC8 1846/4885

“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.