SCHEMBL17200213

SCHEMBL17200213

CCCCCCCC/C=C\CCCCCCCC(=O)ON1CN(CCN2CCN(c3ccccc3OC)CC2)c2c1n(C)c(=O)n(C)c2=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.45
DRD2 P14416 3/20 0.44
DRD3 P35462 1/20 0.44
CYP3A4 P08684 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
PMP22 Q01453 1/20 0.43
HIF1A Q16665 1/20 0.43
HTR7 P34969 2/20 0.42
HTR2A P28223 4/20 0.42
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
KCNH2 Q12809 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
Oleic Acid SCHEMBL17200214 0.75 L3MBTL1 (0.60) HTR1AHTR7HTR2A
Oleic Acid SCHEMBL17200212 0.75 L3MBTL1 (0.60) HTR1AHTR7HTR2A
SCHEMBL12803738 0.75 ADRA2A (0.53) HTR1ADRD2DRD3CYP3A4ADRA2A
SCHEMBL28527312 0.71 HTR1A (0.60) HTR1ADRD2HTR7HTR2AHTR1D
SCHEMBL28519578 0.71 HTR1A (0.60) HTR1ADRD2HTR7HTR2AHTR1D
SCHEMBL11081886 0.71 HTR1A (0.58) HTR1ADRD2DRD3HTR7HTR2A
SCHEMBL2773513 0.70 ADRA1B (0.39) HTR1ADRD2DRD3ADRA1DADRA1A
SCHEMBL28520172 0.69 CNR1 (0.61) HTR1ADRD2HTR7
SCHEMBL28528626 0.69 CNR1 (0.61) HTR1ADRD2HTR7
SCHEMBL28520169 0.69 CNR1 (0.61) HTR1ADRD2HTR7

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
CN-105012306-A SAA derivative compounds in hypoxic state are capable of reducing eNOS and inhibiting oxidative stress induced diseases JIANZHI BIOLOG TECHNOLOGY CO LTD 2015-11-04 CN disclosed
WO-2015161510-A1 SAA DERIVATIVE COMPOUND RESTORES ENOS AND INHIBITS OXIDATIVE STRESS-INDUCED DISEASES IN HYPOXIA JANSFAT BIOTECHNOLOGY CO., LTD. (CN) 2015-10-29 WO disclosed
US-20150306107-A1 SAA Derivative Compound Restores eNOS And Inhibits Oxidative Stress-Induced A Diseases In Hypoxia JANSFAT BIOTECHNOLOGY CO., LTD. (TW) 2015-10-29 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-20150306107-A1 SAA Derivative Compound Restores eNOS And Inhibits Oxidative Stress-Induced A Diseases In Hypoxia SAAL1, HMOX1, HIF1AN HTR1A 3142/4885DRD2 3839/4885DRD3 4053/4885

“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.