SCHEMBL4352299

SCHEMBL4352299

CN(CC(O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.53
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
MT-CO2 P00403 1/20 0.39
MCHR1 Q99705 1/20 0.38
UTS2R Q9UKP6 1/20 0.38
F2R P25116 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C19 P33261 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL2525770 0.88 KMT2A (0.43) AOC3MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL2529693 0.87 AOC3 (0.41) AOC3MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL2532624 0.87 TAAR1 (0.39) AOC3MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2528584 0.86 MEN1 (0.45) AOC3MEN1KMT2AMAPT
SCHEMBL2526417 0.86 KMT2A (0.46) AOC3MEN1KMT2AUTS2RMAPT
SCHEMBL5360820 0.86 AOC3 (0.53) AOC3
SCHEMBL5361268 0.86 AOC3 (0.53) AOC3
SCHEMBL1979471 0.86 MEN1 (0.43) AOC3MEN1KMT2ASMN1; SMN2CYP1A2
SCHEMBL5350824 0.86 AOC3 (0.53) AOC3
SCHEMBL3722932 0.85 AOC3 (0.50) AOC3MEN1KMT2ASMN1; SMN2KDM4E

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-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2009-01-29 US disclosed
WO-2006136823-A1 HETEROCYCLIC CONTAINING AMINES AS KINASE B INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2006-12-28 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-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents HRH1, HRH3, HRH2 AOC3 2105/4885MEN1 1126/4885KMT2A 2317/4885

“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.