SCHEMBL2608975

SCHEMBL2608975

COc1ccc(OC)c(C(O)C(C)C)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 3/20 0.75
▸ ADRA2A P08913 2/20 0.75
▸ CYP2D6 P10635 2/20 0.75
▸ MEN1 O00255 2/20 0.73
▸ KMT2A Q03164 2/20 0.73
▸ MAPK1 P28482 1/20 0.73
▸ BLM P54132 1/20 0.73
▸ SCN1A P35498 1/20 0.65
▸ SCN2A Q99250 1/20 0.65
▸ SCN3A Q9NY46 1/20 0.65
▸ ADRB2 P07550 1/20 0.58
▸ ADRB1 P08588 1/20 0.58
▸ ADRB3 P13945 1/20 0.58
▸ HTT P42858 1/20 0.53
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ ACHE P22303 1/20 0.50
▸ CA12 O43570 1/20 0.50
▸ CA7 P43166 1/20 0.50
▸ CA9 Q16790 1/20 0.50

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
SCHEMBL14197468 1.00 ADRA1A (0.75) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL7786034 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL34158 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL5172508 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL4258097 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL4258100 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL146222 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL29763696 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL1043727 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A
Methoxamine SCHEMBL5172511 0.86 ADRA1A (1.00) ADRA1AADRA2ACYP2D6MEN1KMT2A

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-20120101091-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-26 — — 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-20120101091-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E ADRA1A 2783/4885ADRA2A 3168/4885CYP2D6 526/4885

“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.

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