SCHEMBL13141010

SCHEMBL13141010

COc1cc(C(C)=O)cc(OC)c1CO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 3/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CYP3A4 P08684 2/20 0.42
CA5A P35218 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
CA3 P07451 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL14732689 0.89 LMNA (0.55) LMNAKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL12303222 0.84 LMNA (0.62) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL10317061 0.82 MAPT (0.50) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL28520091 0.81 LMNA (0.58) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL16450475 0.79 LMNA (0.56) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL24488761 0.79 LMNA (0.67) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL10317700 0.78 HSD17B2 (0.59) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL13970537 0.78 LMNA (0.70) LMNAKMT2AMEN1ALDH1A1CA12
Acetosyringone SCHEMBL15511 0.77 LMNA (1.00) LMNAKMT2AMEN1ALDH1A1CA12
SCHEMBL12327904 0.77 LMNA (0.69) LMNAKMT2AMEN1ALDH1A1CA12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552066-B2 Modified chalcone compounds as antimitotic agents ARIZONA BIOMEDICAL RESEARCH COMMISSION (US) 2013-10-08 US disclosed
US-20100222380-A1 Modified Chalcone Compounds as Antimitotic Agents ARIZONA BIOMEDICAL RESEARCH COMMISSION (US) 2010-09-02 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-20100222380-A1 Modified Chalcone Compounds as Antimitotic Agents TUBA1C, SARS1, TUBB1 LMNA 868/4885KMT2A 4469/4885MEN1 4427/4885

“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.