SCHEMBL3715882

SCHEMBL3715882

C[C@H](O)CCC(N)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2C P18825 1/20 0.52
HIF1A Q16665 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.50
TAAR1 Q96RJ0 2/20 0.43
AOC3 Q16853 3/20 0.43
SCN4A P35499 2/20 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
SCHEMBL3715951 1.00 LMNA (0.52) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL2781359 0.84 DPP4 (0.55) TAAR1SCN4A
SCHEMBL2781356 0.84 DPP4 (0.55) TAAR1SCN4A
SCHEMBL2784864 0.84 DPP4 (0.55) TAAR1SCN4A
SCHEMBL13619701 0.83 TAAR1 (0.46) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL13996063 0.83 TAAR1 (0.46) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL26236051 0.81 TAAR1 (0.56) TAAR1AOC3SCN4A
SCHEMBL3651367 0.81 LMNA (0.54) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL27587669 0.80 HRH1 (0.50) LMNAADRA2AADRA2CHIF1AKDM4E
Hydrochloric Acid SCHEMBL15372828 0.79 APAF1 (0.50) LMNAADRA2AADRA2CHIF1AKDM4E

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-20100311798-A1 2-AMINOOXAZOLINES AS TAAR1 LIGANDS HOFFMANN-LA ROCHE, INC. 2010-12-09 US disclosed
WO-2010139707-A1 2-AMINOOXAZOLINES AS TAAR1 LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2010-12-09 WO 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-20100311798-A1 2-AMINOOXAZOLINES AS TAAR1 LIGANDS TAAR1, TAAR5, NPY2R LMNA 3672/4885ADRA2A 83/4885ADRA2C 74/4885

“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.