SCHEMBL16557239

SCHEMBL16557239

O=C(O)c1ccc(C(=O)NCCCCO)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.68
MAPK1 P28482 1/20 0.61
ALDH1A1 P00352 1/20 0.53
HDAC1 Q13547 4/20 0.53
HDAC2 Q92769 4/20 0.53
HDAC8 Q9BY41 4/20 0.53
HDAC6 Q9UBN7 4/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
HDAC3 O15379 3/20 0.53
HDAC4 P56524 3/20 0.53
HDAC7 Q8WUI4 3/20 0.53
HDAC10 Q969S8 3/20 0.53
HDAC11 Q96DB2 3/20 0.53
HDAC9 Q9UKV0 3/20 0.53
HDAC5 Q9UQL6 3/20 0.53
NAAA Q02083 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
NAMPT P43490 1/20 0.51
HSP90AA1 P07900 1/20 0.50

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
SCHEMBL1663183 0.91 POLB (0.57) POLBMAPK1ALDH1A1HDAC1HDAC2
SCHEMBL10363539 0.90 MAPK1 (0.72) POLBMAPK1ALDH1A1HDAC1HDAC2
SCHEMBL29833827 0.90 POLB (0.74) POLBMAPK1ALDH1A1HDAC1HDAC2
SCHEMBL1039449 0.87 HDAC1 (0.69) POLBMAPK1HDAC1HDAC2HDAC8
SCHEMBL23471096 0.86 POLB (0.58) POLBMAPK1ALDH1A1HDAC2HDAC8
SCHEMBL9717433 0.86 POLB (0.68) POLBMAPK1ALDH1A1NPC1RAB9A
SCHEMBL9321669 0.85 HDAC1 (0.72) POLBMAPK1ALDH1A1HDAC1HDAC2
SCHEMBL7906054 0.85 HDAC1 (0.72) POLBMAPK1ALDH1A1HDAC1HDAC2
SCHEMBL2975968 0.84 DRD2 (0.68) POLBMAPK1HDAC1HDAC2HDAC8
SCHEMBL7393206 0.84 POLB (0.66) POLBMAPK1HDAC1HDAC6NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160376589-A1 micro-RNA INHIBITOR BONAC CORPORATION (JP) 2016-12-29 US disclosed
US-9404108-B2 Micro-RMA inhibitor BONAC CORPORATION (JP) 2016-08-02 US disclosed
US-20150073124-A1 micro-RNA INHIBITOR BONAC CORPORATION (JP) 2015-03-12 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-20150073124-A1 micro-RNA INHIBITOR AGO2, SLIRP, MSI2 POLB 922/4885MAPK1 1681/4885ALDH1A1 4305/4885

“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.