SCHEMBL1644845

SCHEMBL1644845

CC(C)c1ccc(COC(=O)c2ccccc2OC(=O)c2ccccc2OCc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
HPGD P15428 1/20 0.53
XBP1 P17861 1/20 0.53
HTT P42858 1/20 0.52
PARP1 P09874 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
HPD P32754 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
EGFR P00533 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL128622 0.82 RXRA (0.57) KDM4EHPGDPARP1KMT2ARXRA
SCHEMBL9574717 0.82 HTT (0.73) KDM4EHTTPARP1MEN1KMT2A
SCHEMBL8415759 0.81 HTT (0.59) KDM4EHTTPARP1MEN1KMT2A
SCHEMBL1648346 0.81 HTT (0.50) KDM4EHTTMEN1KMT2ANPSR1
SCHEMBL4415350 0.80 HTT (0.75) HTTPARP1MEN1KMT2ANPSR1
SCHEMBL39675 0.80 TDP1 (0.69) KDM4EHTTMEN1KMT2ANPSR1
SCHEMBL29611559 0.80 TDP1 (0.69) KDM4EHTTMEN1KMT2ANPSR1
Benzyl Salicylate SCHEMBL10560506 0.77 TDP1 (0.75) KDM4EMEN1KMT2ANPSR1ALDH1A1
SCHEMBL11153592 0.76 KDM4E (0.62) KDM4EHPGDHTTPARP1MEN1
SCHEMBL21376003 0.75 KMT2A (0.69) HPGDMEN1KMT2ANPSR1SMN1; SMN2

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-20110097288-A1 Sun Protection Composition HENKEL AG & CO. KGAA (DE) 2011-04-28 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-20110097288-A1 Sun Protection Composition MGLL, DAGLA, ERCC4 KDM4E 585/4885HPGD 788/4885XBP1 3994/4885

“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.