SCHEMBL6508053

SCHEMBL6508053

OCCCOc1ccccc1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
LMNA P02545 3/20 0.65
POLB P06746 1/20 0.65
TP53 P04637 1/20 0.65
MAPK1 P28482 1/20 0.65
RAB9A P51151 1/20 0.65
HTR7 P34969 1/20 0.61
HTT P42858 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
KDM4E B2RXH2 5/20 0.58
ADRB2 P07550 4/20 0.57
ALDH1A1 P00352 4/20 0.57
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 1/20 0.54
ADRB1 P08588 1/20 0.54
PKM P14618 1/20 0.54

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
SCHEMBL2838771 0.94 KMT2A (0.65) MEN1KMT2ALMNAPOLBTP53
SCHEMBL25124077 0.93 MEN1 (0.60) MEN1KMT2ALMNAPOLBTP53
SCHEMBL583477 0.92 KMT2A (0.63) MEN1KMT2ALMNAPOLBTP53
SCHEMBL28666392 0.92 KMT2A (0.63) MEN1KMT2ALMNAPOLBTP53
SCHEMBL582556 0.92 KMT2A (0.63) MEN1KMT2ALMNAPOLBTP53
SCHEMBL29418129 0.92 TP53 (0.69) MEN1KMT2ALMNAPOLBTP53
SCHEMBL159005 0.92 TP53 (0.69) MEN1KMT2ALMNAPOLBTP53
SCHEMBL13740267 0.90 TP53 (0.71) MEN1KMT2ALMNAPOLBTP53
SCHEMBL15522001 0.90 TP53 (0.71) MEN1KMT2ALMNAPOLBTP53
SCHEMBL9857798 0.88 TP53 (0.65) MEN1KMT2ALMNAPOLBTP53

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-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA MEN1 4860/4885KMT2A 2887/4885LMNA 3747/4885

“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.