SCHEMBL12417367

SCHEMBL12417367

CCOC(=O)NCCCCCNC(=O)OCC

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.61
EPHX1 P07099 1/20 0.59
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
NCOR2 Q9Y618 1/20 0.49

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
SCHEMBL7781306 1.00 ACHE (0.61) ACHEEPHX1HDAC3HDAC4HDAC1
SCHEMBL27712904 1.00 ACHE (0.61) ACHEEPHX1HDAC3HDAC4HDAC1
SCHEMBL1023071 1.00 ACHE (0.61) ACHEEPHX1HDAC3HDAC4HDAC1
SCHEMBL7570219 0.98 ACHE (0.61) ACHEEPHX1HDAC3HDAC4HDAC1
SCHEMBL5696599 0.94 EPHX1 (0.70) ACHEEPHX1
SCHEMBL1857424 0.94 EPHX1 (0.70) ACHEEPHX1
SCHEMBL1836300 0.94 ACHE (0.55) ACHEEPHX1HDAC3HDAC4HDAC1
SCHEMBL4647121 0.94 EPHX1 (0.70) ACHEEPHX1
SCHEMBL2987477 0.94 EPHX1 (0.70) ACHEEPHX1
SCHEMBL2987259 0.94 EPHX1 (0.70) ACHEEPHX1

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-20230140883-A1 NOVEL MEMBRANES AND PREPARATION THEREOF IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-05-11 US disclosed
US-9446139-B2 Polymer-based compositions and conjugates of HIV entry inhibitors NEKTAR THERAPEUTICS (US) 2016-09-20 US disclosed
US-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 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-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES TMSB4X, TMSB10, TAP1 ACHE 3516/4885EPHX1 1086/4885HDAC3 4661/4885

“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.