SCHEMBL17037206

SCHEMBL17037206

OCCCCn1cc(-c2ccc(CO)cc2)nn1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 16/20 0.48
HDAC4 P56524 16/20 0.48
HDAC1 Q13547 16/20 0.48
HDAC7 Q8WUI4 16/20 0.48
HDAC2 Q92769 16/20 0.48
HDAC10 Q969S8 16/20 0.48
HDAC11 Q96DB2 16/20 0.48
HDAC8 Q9BY41 16/20 0.48
HDAC6 Q9UBN7 16/20 0.48
HDAC9 Q9UKV0 16/20 0.48
HDAC5 Q9UQL6 16/20 0.48
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46

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
SCHEMBL17037208 0.98 HDAC8 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17037196 0.85 ALOX5 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17037191 0.82 HDAC3 (0.66) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17037192 0.81 HDAC8 (0.67) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17040251 0.81 HDAC3 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13573678 0.80 HDAC8 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17037203 0.79 HDAC6 (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL3737841 0.78 PTGS2 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17091027 0.76 EPHB4 (0.43)
SCHEMBL16212713 0.74 NAMPT (0.75) HDAC3HDAC4HDAC1HDAC7HDAC2

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-9376385-B2 Solid-phase supports and uses thereof INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-06-28 US disclosed
US-20150240006-A1 Solid-Phase Supports and Uses Thereof INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION 2015-08-27 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-20150240006-A1 Solid-Phase Supports and Uses Thereof ACR, ALK, ALKBH3 HDAC3 4530/4885HDAC4 4391/4885HDAC1 4641/4885

“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.