SCHEMBL741005

SCHEMBL741005

Nc1ccc(OCCCCCCCCCCC(=O)NO)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.71
HDAC2 Q92769 8/20 0.71
HDAC6 Q9UBN7 5/20 0.68
HDAC3 O15379 4/20 0.68
HDAC4 P56524 4/20 0.68
HDAC7 Q8WUI4 4/20 0.68
HDAC10 Q969S8 4/20 0.68
HDAC11 Q96DB2 4/20 0.68
HDAC8 Q9BY41 4/20 0.68
HDAC9 Q9UKV0 4/20 0.68
HDAC5 Q9UQL6 4/20 0.68
MMP3 P08254 1/20 0.61
STAT3 P40763 1/20 0.58

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
SCHEMBL13954825 0.95 HDAC1 (0.76) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8092309 0.93 HDAC1 (0.61) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8660751 0.82 HDAC1 (0.69) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL17265696 0.81 PPARA (0.61) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL19789098 0.81 HDAC1 (0.97) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL839412 0.81 PPARA (0.61) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL3383144 0.81 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL7044810 0.81 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL831000 0.81 HDAC1 (0.50) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL13933074 0.81 HDAC1 (0.50) HDAC1HDAC2HDAC6HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1976795-B1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION IBM (US) 2016-04-13 EP disclosed
US-8859048-B2 Selective placement of carbon nanotubes through functionalization INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-10-14 US disclosed
US-8604559-B2 Method of placing a semiconducting nanostructure and semiconductor device including the semiconducting nanostructure INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-12-10 US disclosed
US-8283453-B2 Selective placement of carbon nanotubes through functionalization INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-10-09 US disclosed
US-8138102-B2 Method of placing a semiconducting nanostructure and semiconductor device including the semiconducting nanostructure INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-20 US disclosed
US-8084012-B2 Selective placement of carbon nanotubes through functionalization INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-12-27 US disclosed
US-20110180777-A1 METHOD OF PLACING A SEMICONDUCTING NANOSTRUCTURE AND SEMICONDUCTOR DEVICE INCLUDING THE SEMICONDUCTING NANOSTRUCTURE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-07-28 US disclosed
US-20100145034-A1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-06-10 US disclosed
US-20100044678-A1 METHOD OF PLACING A SEMICONDUCTING NANOSTRUCTURE AND SEMICONDUCTOR DEVICE INCLUDING THE SEMICONDUCTING NANOSTRUCTURE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-02-25 US disclosed
US-20090301349-A1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2009-12-10 US disclosed
EP-1976795-A1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION International Business Machines Corporation (US) 2008-10-08 EP disclosed
US-20080102213-A1 Selective placement of carbon nanotubes through functionalization INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2008-05-01 US disclosed
WO-2007077078-A1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-07-12 WO 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 (1 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-20100145034-A1 SELECTIVE PLACEMENT OF CARBON NANOTUBES THROUGH FUNCTIONALIZATION NOXO1, EPCAM, SCO2 HDAC1 2966/4885HDAC2 3581/4885HDAC6 2805/4885

“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.