SCHEMBL16480261

SCHEMBL16480261

COCCOc1cc(CCNc2ccc3c4c(cccc24)C(=O)N(CCNC(=O)CCN2C(=O)C=CC2=O)C3=O)ccc1N1CCOc2cc(C)ccc2N2CCOCCOCCN(CCOCCOCC2)c2ccc(C)cc2OCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.41
HDAC8 Q9BY41 3/20 0.41
HDAC10 Q969S8 2/20 0.41
RAB9A P51151 1/20 0.40
HDAC3 O15379 4/20 0.40
HDAC1 Q13547 4/20 0.40
HDAC11 Q96DB2 3/20 0.40
NCOR2 Q9Y618 3/20 0.40
HDAC2 Q92769 3/20 0.40
LMNA P02545 4/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 3/20 0.38
CYP2C19 P33261 3/20 0.38
CYP2D6 P10635 1/20 0.38
PIK3CA P42336 1/20 0.37
PRKDC P78527 1/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
RECQL P46063 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
SCHEMBL16480262 0.88 HDAC6 (0.42) HDAC6HDAC8HDAC10HDAC3HDAC1
SCHEMBL16480267 0.86 MEN1 (0.42) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL16480266 0.86 MEN1 (0.42) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL16480252 0.86 MEN1 (0.41) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL23964219 0.85 HDAC6 (0.48) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL16480246 0.83 HDAC6 (0.38) HDAC6HDAC8HDAC10HDAC3HDAC1
SCHEMBL23775122 0.81 HDAC6 (0.46) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL16480243 0.79 DHFR (0.34) HDAC6HDAC8HDAC10HDAC3HDAC1
SCHEMBL16480253 0.79 MEN1 (0.37) HDAC6HDAC8HDAC10RAB9AHDAC3
SCHEMBL16480260 0.78 ITGB3 (0.32)

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-9181375-B2 Fluorescent potassium ion sensors ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2015-11-10 US disclosed
US-20140200319-A1 FLUORESCENT POTASSIUM ION SENSORS Arizona Board of Regents, a body corporate of the State of Arizona Acting for and on behalf of Arizo (US) 2014-07-17 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-20140200319-A1 FLUORESCENT POTASSIUM ION SENSORS KCNN1, KCNN2, KCNN3 HDAC6 3054/4885HDAC8 3694/4885HDAC10 3507/4885

“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.