SCHEMBL17138144

SCHEMBL17138144

CC(C)CC(=O)Oc1cccc(OC(=O)CC(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
ALOX15 P16050 1/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ACHE P22303 3/20 0.47
LMNA P02545 1/20 0.47
ELANE P08246 1/20 0.46
MTNR1B P49286 3/20 0.46
CYP3A4 P08684 1/20 0.43
KDM4E B2RXH2 1/20 0.41
NSD2 O96028 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FAAH O00519 1/20 0.41
BCHE P06276 1/20 0.41
MTNR1A P48039 2/20 0.41

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
SCHEMBL7814632 0.88 HPGD (0.49) ALDH1A1ALOX15KMT2AMEN1ACHE
SCHEMBL8370146 0.88 OGG1 (0.50) ALDH1A1ALOX15KMT2AACHEKDM4E
SCHEMBL666155 0.86 POLB (0.47) ALDH1A1ALOX15KMT2AMEN1LMNA
SCHEMBL28988613 0.85 TRPV1 (0.46) ALDH1A1ALOX15ACHELMNAELANE
SCHEMBL30367258 0.85 TRPV1 (0.46) ALDH1A1ALOX15ACHELMNAELANE
SCHEMBL17138194 0.84 ELANE (0.66) ALDH1A1KMT2AMEN1ACHELMNA
SCHEMBL17138222 0.81 KMT2A (0.46) ALDH1A1KMT2AMEN1ACHELMNA
SCHEMBL17138172 0.81 ACHE (0.42) ALDH1A1KMT2AMEN1ACHELMNA
Phenol SCHEMBL9251256 0.80 MIF (0.45) ALDH1A1ALOX15ELANECYP3A4
SCHEMBL10030198 0.79 L3MBTL1 (0.47) ALDH1A1KMT2ALMNAMTNR1BKDM4E

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-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF RNS CO.,LTD. (KR) 2015-10-08 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-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF HRH3, CBR3, H1-0 ALDH1A1 133/4885ALOX15 87/4885KMT2A 580/4885

“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.