SCHEMBL5463176

SCHEMBL5463176

NC(O)(O)C(O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.50
LMNA P02545 4/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2C P18825 1/20 0.43
HIF1A Q16665 1/20 0.43
KDM4E B2RXH2 1/20 0.43
DPP4 P27487 2/20 0.42
F2 P00734 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL9577935 0.81 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL29833611 0.79 LMNA (0.47) AOC3LMNAHIF1ACES2CES1
SCHEMBL3397481 0.79 AOC3 (0.48) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL411887 0.78 AOC3 (0.59) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL26025745 0.78 AOC3 (0.59) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL9029040 0.76 AOC3 (0.47) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL6743744 0.76 AOC3 (0.47) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL10626895 0.76 AOC3 (0.52) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL10599811 0.76 AOC3 (0.52) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL10599803 0.76 AOC3 (0.52) AOC3LMNAADRA2AADRA2CHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070190187-A1 FORMULATION FOR ENHANCED DELIVERY OF PHENETHYLAMINE KNELLER BRUCE W 2007-08-16 US disclosed
EP-0400478-A2 Branched polycarbonates and method of preparation GENERAL ELECTRIC COMPANY (US) 1990-12-05 EP disclosed
EP-0378858-A2 Process for the preparation of branched thermoplastic polycarbonates GENERAL ELECTRIC COMPANY (US) 1990-07-25 EP 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-20070190187-A1 FORMULATION FOR ENHANCED DELIVERY OF PHENETHYLAMINE MAOB, PNMT, MAOA AOC3 217/4885LMNA 1997/4885ADRA2A 194/4885

“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.