SCHEMBL17138183

SCHEMBL17138183

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

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
LMNA P02545 3/20 0.50
CYP3A4 P08684 1/20 0.50
ACHE P22303 4/20 0.46
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
BCHE P06276 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38

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
SCHEMBL8559363 0.89 LMNA (0.68) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL8759992 0.87 CYP1A2 (0.51) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL1405221 0.85 ELANE (0.47) KMT2A
SCHEMBL3178391 0.79 KMT2A (0.46) KMT2AMEN1NPC1
SCHEMBL249305 0.78 LMNA (0.76) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL17028900 0.78 LMNA (0.76) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL17138182 0.78 KMT2A (0.50) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL17138180 0.78 KMT2A (0.50) KMT2AMEN1LMNACYP3A4ACHE
SCHEMBL3186605 0.77 KDM4E (0.46) KMT2ALMNAACHE
SCHEMBL4781565 0.76 MAPK1 (0.43) KMT2AMEN1LMNAACHE

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 4684/4885LMNA 1443/4885

“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.