SCHEMBL15065079

SCHEMBL15065079

NCCCNCCCCNC(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 5/20 0.63
GRIN2A Q12879 5/20 0.63
GRIN2B Q13224 3/20 0.63
HDAC1 Q13547 5/20 0.61
HDAC2 Q92769 5/20 0.61
HDAC8 Q9BY41 4/20 0.61
HDAC6 Q9UBN7 4/20 0.61
HDAC3 O15379 4/20 0.61
HDAC4 P56524 3/20 0.61
HDAC7 Q8WUI4 3/20 0.61
HDAC10 Q969S8 3/20 0.61
HDAC11 Q96DB2 3/20 0.61
HDAC9 Q9UKV0 3/20 0.61
HDAC5 Q9UQL6 3/20 0.61
NAAA Q02083 1/20 0.61
DRD2 P14416 1/20 0.60
DRD4 P21917 1/20 0.60
DRD3 P35462 1/20 0.60
NPC1 O15118 1/20 0.58
RAB9A P51151 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
SCHEMBL12085668 0.98 GRIN1 (0.65) GRIN1GRIN2AGRIN2BHDAC1HDAC2
SCHEMBL15065078 0.95 GRIN1 (0.61) GRIN1GRIN2AGRIN2BHDAC1HDAC2
SCHEMBL1467538 0.93 NPC1 (0.66) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL19874469 0.91 NPC1 (0.64) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL5855204 0.91 HDAC1 (0.67) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL8366892 0.90 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL4426060 0.90 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL13709041 0.90 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL3869201 0.90 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL3863086 0.90 HDAC1 (0.70) HDAC1HDAC2HDAC8HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741807-B2 Plant activator THE UNIVERSITY OF TOKYO (JP) 2014-06-03 US disclosed
US-20130172189-A1 PLANT ACTIVATOR THE UNIVERSITY OF TOKYO (JP) 2013-07-04 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 (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-20130172189-A1 PLANT ACTIVATOR APEH, NMRAL1, NAAA GRIN1 1919/4885GRIN2A 1861/4885GRIN2B 3064/4885

“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.