SCHEMBL24339797

SCHEMBL24339797

CCOC(=O)C1CCCN(C(O)C(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.51
KDM4E B2RXH2 7/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTT P42858 1/20 0.47
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 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
SCHEMBL18893040 0.84 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL12259083 0.82 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL1911484 0.82 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL12258816 0.82 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL23717395 0.81 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL7294395 0.80 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL13239678 0.77 KDM4E (0.57) ALDH1A1KDM4ESMN1; SMN2TDP1ATM
SCHEMBL8259396 0.77 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL14874211 0.76 KDM4E (0.63) ALDH1A1KDM4ESMN1; SMN2TDP1ATM
SCHEMBL8438204 0.76 KDM4E (0.63) ALDH1A1KDM4ESMN1; SMN2TDP1ATM

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-20220098214-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING FIBROSIS YALE UNIVERSITY 2022-03-31 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-20220098214-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING FIBROSIS DUSP5, DUSP4, DUSP6 ALDH1A1 1762/4885KDM4E 902/4885SMN1; SMN2 3092/4885

“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.