SCHEMBL1986202

SCHEMBL1986202

C[CH]COc1cccc(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.55
LMNA P02545 1/20 0.53
MAPK1 P28482 2/20 0.51
APP P05067 1/20 0.50
TSHR P16473 1/20 0.50
ACHE P22303 1/20 0.47
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
KDM4E B2RXH2 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
NPSR1 Q6W5P4 1/20 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
SCHEMBL123591 0.82 MAOB (0.53) MAOBLMNAMAPK1APPTSHR
SCHEMBL29705591 0.82 LMNA (0.56) MAOBLMNAMAPK1APPTSHR
SCHEMBL2552483 0.82 LMNA (0.56) MAOBLMNAMAPK1APPTSHR
SCHEMBL19899163 0.80 ACHE (0.52) MAOBLMNAACHEKDM4EALDH1A1
SCHEMBL10904568 0.79 MAOB (0.50) MAOBLMNAMAPK1APPTSHR
SCHEMBL791805 0.79 LMNA (0.53) MAOBLMNAMAPK1APPTSHR
SCHEMBL5145798 0.79 CA1 (0.52) MAOBLMNAMAPK1APPTSHR
SCHEMBL11306471 0.79 MAOB (0.62) MAOBLMNAMAPK1APPTSHR
SCHEMBL1729519 0.79 MAPK1 (0.75) MAOBLMNAMAPK1APPTSHR
SCHEMBL19899160 0.78 WDR5 (0.50) MAOBLMNAMAPK1KDM4E

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-8476197-B2 Aminopropenoates as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-02 US disclosed
US-20110152322-A1 Aminopropenoates as Fungicides BAYER CROPSCIENCE AG (DE) 2011-06-23 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-20110152322-A1 Aminopropenoates as Fungicides AASDHPPT, DAO, AAAS MAOB 828/4885LMNA 1991/4885MAPK1 3338/4885

“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.