SCHEMBL3244306

SCHEMBL3244306

CC(C)(C)OC(=O)NC(CCCC(N)=O)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 14/20 0.50
CTSS P25774 5/20 0.48
HDAC4 P56524 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CAPN1 P07384 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40

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
SCHEMBL13263354 0.92 CTSK (0.44) CTSKCTSSCA1CA2CA7
SCHEMBL28313142 0.89 FOLH1 (0.51) CTSKCTSSCAPN1MEN1GAA
SCHEMBL11506791 0.89 CTSK (0.49) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL7977067 0.87 CTSK (0.65) CTSKCTSS
SCHEMBL5967151 0.87 CTSK (0.65) CTSKCTSS
SCHEMBL13385258 0.87 CTSK (0.50) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL8577155 0.87 CTSK (0.65) CTSKCTSS
SCHEMBL2804552 0.86 CTSK (0.49) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL12015102 0.86 CTSK (0.49) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL5615480 0.84 CTSK (0.58) CTSKCTSSHDAC4HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100152452-A1 STEREOSELECTIVE SYNTHESIS OF PIPERIDINE DERIVATIVES TAIGEN BIOTECHNOLOGY CO., LTD. (TW) 2010-06-17 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-20100152452-A1 STEREOSELECTIVE SYNTHESIS OF PIPERIDINE DERIVATIVES DHPS, AZI2, DPYD CTSK 4224/4885CTSS 3427/4885HDAC4 2268/4885

“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.