SCHEMBL17138222

SCHEMBL17138222

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ACHE P22303 3/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
CYP3A4 P08684 1/20 0.41
GALR3 O60755 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NSD2 O96028 1/20 0.39
FAAH O00519 1/20 0.39
BCHE P06276 1/20 0.39

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
SCHEMBL666850 0.87 ALDH1A1 (0.48) KMT2AMEN1LMNAALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL28310523 0.86 ALDH1A1 (0.47) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL17138199 0.85 ELANE (0.48) KMT2AMEN1ACHELMNAALDH1A1
SCHEMBL17138144 0.81 ALDH1A1 (0.51) KMT2AMEN1ACHELMNAALDH1A1
SCHEMBL2636796 0.80 ALDH1A1 (0.43) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL15547394 0.79 ALDH1A1 (0.50) KMT2AMEN1ACHELMNAALDH1A1
SCHEMBL421378 0.79 BCL9 (0.53) KMT2AMEN1ACHELMNAALDH1A1
SCHEMBL28609294 0.79 CNR1 (0.40) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL9724792 0.78 MAPT (0.51) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL17138135 0.78 LMNA (0.52) KMT2AMEN1ACHELMNAALDH1A1

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 KMT2A 580/4885MEN1 4684/4885ACHE 2498/4885

“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.