SCHEMBL25868870

SCHEMBL25868870

CC(=O)c1ccc(CNc2nc(NCC3CCCCC3)nc(NC3CC4CCC3C4)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VCP P55072 7/20 0.44
HDAC6 Q9UBN7 1/20 0.42
TPH1 P17752 1/20 0.40
CNR2 P34972 1/20 0.38
HDAC1 Q13547 1/20 0.38
ENO1 P06733 1/20 0.37
HTT P42858 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PANK3 Q9H999 1/20 0.35
EPHX1 P07099 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL24724733 0.91 ALDH1A1 (0.46) VCPHDAC6TPH1CNR2HDAC1
SCHEMBL23346071 0.90 HDAC6 (0.40) VCPHDAC6TPH1CNR2HDAC1
SCHEMBL21479645 0.90 HDAC6 (0.40) VCPHDAC6TPH1CNR2HDAC1
SCHEMBL24933040 0.85 LMNA (0.42) VCPCNR2HTTHPGDSMN1; SMN2
SCHEMBL23386772 0.81 ENO1 (0.55) HDAC6HDAC1ENO1SMN1; SMN2
SCHEMBL13607364 0.81 ENO1 (0.55) HDAC6HDAC1ENO1SMN1; SMN2
SCHEMBL24724735 0.80 ENO1 (0.43) HDAC6ENO1ACACB
SCHEMBL24724746 0.78 CNR2 (0.37) VCPTPH1CNR2ENO1
SCHEMBL24724734 0.77 TPH1 (0.39) TPH1CNR2EPHX1
SCHEMBL25897581 0.72 HDAC6 (0.41) VCPHDAC6TPH1HDAC1ENO1

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-20230233689-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins UNIV YALE (US) 2023-07-27 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-20230233689-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins ASGR1, LDLR, FCGR2A VCP 3148/4885HDAC6 4094/4885TPH1 3887/4885

“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.