SCHEMBL22855408

SCHEMBL22855408

CCOC(=O)C1CC=C(O)CC1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA1 P00915 8/20 0.38
CA2 P00918 8/20 0.38
CA9 Q16790 6/20 0.38
CA12 O43570 6/20 0.38
PKM P14618 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
SCHEMBL18806637 0.85 ALDH1A1 (0.40) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL17802864 0.83 KDM4E (0.38) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL13369214 0.83 KMT2A (0.38) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL25768390 0.78 ALOX15 (0.42) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL1196453 0.75 CA1 (0.45) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL11248916 0.75 CA1 (0.45) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL10632677 0.74 KDM4E (0.37) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL13003098 0.74 KDM4E (0.37) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL10632680 0.74 KDM4E (0.37) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL10632683 0.74 KDM4E (0.37) KDM4EMAPTMEN1ALDH1A1GAA

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-20200407341-A1 INHIBITORS OF RET BLUEPRINT MEDICINES CORPORATION 2020-12-31 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-20200407341-A1 INHIBITORS OF RET RET, HRAS, RB1 KDM4E 1083/4885MAPT 1447/4885MEN1 376/4885

“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.