SCHEMBL4761607

SCHEMBL4761607

CCCCOC(=O)On1nnc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 3/20 0.53
▸ HDAC4 P56524 3/20 0.53
▸ HDAC1 Q13547 3/20 0.53
▸ HDAC7 Q8WUI4 3/20 0.53
▸ HDAC2 Q92769 3/20 0.53
▸ HDAC10 Q969S8 3/20 0.53
▸ HDAC11 Q96DB2 3/20 0.53
▸ HDAC8 Q9BY41 3/20 0.53
▸ HDAC6 Q9UBN7 3/20 0.53
▸ HDAC9 Q9UKV0 3/20 0.53
▸ HDAC5 Q9UQL6 3/20 0.53
▸ MGAM O43451 1/20 0.53
▸ AMY1A P0DUB6 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ SI P14410 1/20 0.53
▸ MGAM2 Q2M2H8 1/20 0.53
▸ SIRT2 Q8IXJ6 3/20 0.48
▸ SLC9A1 P19634 4/20 0.47
▸ ASAH1 Q13510 1/20 0.46
▸ MEN1 O00255 1/20 0.45

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
SCHEMBL15579261 0.95 ASAH1 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12254053 0.92 HDAC3 (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9910889 0.88 HDAC3 (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15280783 0.87 SIRT2 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL277619 0.86 HDAC3 (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10299923 0.85 HDAC3 (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15459767 0.85 SIRT2 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL125531 0.85 SIRT2 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9910892 0.85 SIRT2 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6814267 0.84 HDAC3 (0.50) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140066593-A1 PROCESS FOR A FOLATE-TARGETED AGENT ENDOCYTE, INC. (US) 2014-03-06 — — US disclosed
US-20130065841-A1 PROCESS FOR A FOLATE-TARGETED AGENT ENDOCYTE, INC. (US) 2013-03-14 — — US disclosed
US-20120123065-A1 Hydrolytically Stable Maleimide-Terminated Polymers NEKTAR THERAPEUTICS (US) 2012-05-17 — — US disclosed
US-8106131-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS (US) 2012-01-31 — — US disclosed
US-20090012241-A1 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-01-08 — — US disclosed
US-7432331-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 — — US disclosed
US-7432330-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 — — 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 (2 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-20130065841-A1 PROCESS FOR A FOLATE-TARGETED AGENT FOLR1, FOLR2, DHFR HDAC3 4734/4885HDAC4 4498/4885HDAC1 4808/4885
US-20140066593-A1 PROCESS FOR A FOLATE-TARGETED AGENT FOLR1, FOLR2, SLC46A1 HDAC3 4726/4885HDAC4 4309/4885HDAC1 4802/4885

“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.

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