2-Isopropyl-3-Methoxycinnamic Acid

2-Isopropyl-3-Methoxycinnamic Acid

SCHEMBL2280937

COc1cccc(C=CC(=O)O)c1C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 1.00
GAA P10253 1/20 0.54
NFE2L2 Q16236 4/20 0.51
TFEB P19484 1/20 0.51
LMNA P02545 3/20 0.50
NPC1 O15118 2/20 0.50
MAPT P10636 2/20 0.50
RAB9A P51151 2/20 0.50
BCHE P06276 1/20 0.50
HTT P42858 1/20 0.49
PTGER4 P35408 1/20 0.46
PTGER3 P43115 1/20 0.46
PTGER2 P43116 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 2/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.45

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
2-Isopropyl-3-Methoxycinnamic Acid SCHEMBL2280935 1.00 KDM4E (1.00) KDM4EGAANFE2L2TFEBLMNA
SCHEMBL5179255 0.86 KDM4E (0.76) KDM4EGAANFE2L2TFEBLMNA
Coumarinic Acid Methyl Ether SCHEMBL22092089 0.81 KDM4E (0.68) KDM4EGAANFE2L2TFEBLMNA
SCHEMBL9689786 0.81 KDM4E (0.68) KDM4EGAANFE2L2TFEBLMNA
SCHEMBL16831490 0.81 KDM4E (0.68) KDM4EGAANFE2L2TFEBLMNA
Coumarinic Acid Methyl Ether SCHEMBL83064 0.80 NFE2L2 (0.77) KDM4EGAANFE2L2TFEBLMNA
Coumarinic Acid Methyl Ether SCHEMBL29369917 0.80 NFE2L2 (0.77) KDM4EGAANFE2L2TFEBLMNA
Coumarinic Acid Methyl Ether SCHEMBL79060 0.80 NFE2L2 (0.77) KDM4EGAANFE2L2TFEBLMNA
Coumarinic Acid Methyl Ether SCHEMBL714857 0.80 NFE2L2 (0.77) KDM4EGAANFE2L2TFEBLMNA
SCHEMBL1056670 0.80 NFE2L2 (0.79) KDM4EGAANFE2L2TFEBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110189310-A1 SMALL MOLECULE MODULATORS OF PRONGF UPTAKE CORNELL UNIVERSITY (US) 2011-08-04 US claimed
WO-2010042728-A1 SMALL MOLECULE MODULATORS OF PRONGF UPTAKE CORNELL UNIVERSITY (US) 2010-04-15 WO claimed
US-20110189310-A1 SMALL MOLECULE MODULATORS OF PRONGF UPTAKE CORNELL UNIVERSITY (US) 2011-08-04 US disclosed
WO-2010042728-A1 SMALL MOLECULE MODULATORS OF PRONGF UPTAKE CORNELL UNIVERSITY (US) 2010-04-15 WO disclosed
US-20090143279-A1 Methods and compositions for treating metabolic disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2009-06-04 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-20090143279-A1 Methods and compositions for treating metabolic disorders PC, PCK2, CS KDM4E 3739/4885GAA 91/4885NFE2L2 324/4885

“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.