SCHEMBL10076684

SCHEMBL10076684

CC(=O)OC(/C=C/c1ccccc1)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.47
PPARA Q07869 2/20 0.47
CNR2 P34972 1/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 1/20 0.42
SRR Q9GZT4 2/20 0.41
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALPI P09923 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41
SLC7A5 Q01650 1/20 0.41
NOS2 P35228 1/20 0.40
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 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
SCHEMBL27580730 0.81 ALDH1A1 (0.46) PPARGPPARAMEN1KMT2ASRR
SCHEMBL4517205 0.81 ALDH1A1 (0.46) PPARGPPARAMEN1KMT2ASRR
SCHEMBL20598268 0.81 MEN1 (0.41) CNR2MEN1KMT2AGLATDP1
SCHEMBL10404341 0.80 ALDH1A1 (0.44) PPARGPPARALMNASRRCYP1A2
SCHEMBL8376755 0.80 ALDH1A1 (0.44) PPARGPPARALMNASRRCYP1A2
SCHEMBL7052640 0.79 MEN1 (0.40) CNR2MEN1KMT2AGLATDP1
SCHEMBL7052644 0.79 MEN1 (0.40) CNR2MEN1KMT2AGLATDP1
SCHEMBL20598401 0.79 MEN1 (0.40) CNR2MEN1KMT2AGLATDP1
SCHEMBL7097856 0.79 TDP1 (0.52) CNR2KMT2AGLATDP1LMNA
SCHEMBL1199677 0.79 TDP1 (0.52) CNR2KMT2AGLATDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077989-A1 CYCLIC IMIDATE LIGANDS UNIVERSITEIT GENT (BE) 2012-03-29 US disclosed
US-20120077989-A1 CYCLIC IMIDATE LIGANDS UNIVERSITEIT GENT (BE) 2012-03-29 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-20120077989-A1 CYCLIC IMIDATE LIGANDS IDH2, CYCS, NAPRT PPARG 1633/4885PPARA 1681/4885CNR2 1052/4885

“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.