SCHEMBL889188

SCHEMBL889188

CCCOC(=O)CCN(CCO)CCN(CCC(=O)OCCC)CCC(=O)OCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.42
DGKA P23743 1/20 0.41
MGLL Q99685 1/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
BLM P54132 1/20 0.34
HTR2C P28335 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 2/20 0.33
NAAA Q02083 1/20 0.33
MAPK1 P28482 1/20 0.33
GLA P06280 1/20 0.33
TOP2A P11388 1/20 0.33

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
SCHEMBL889305 0.95 DNM1 (0.41) DNM1DGKAMGLLMAPTKDM4E
SCHEMBL17426970 0.93 DNM1 (0.44) DNM1DGKAMGLLMAPTADRA2A
SCHEMBL889222 0.92 DNM1 (0.47) DNM1DGKAMAPTADRA2AADRA1A
SCHEMBL12120246 0.90 DNM1 (0.48) DNM1DGKAMAPTADRA2AADRA1A
SCHEMBL13015151 0.89 DNM1 (0.47) DNM1DGKAMGLLHTR2CTHRA
SCHEMBL21512458 0.87 DNM1 (0.49) DNM1DGKAMGLLHTR2CTHRA
SCHEMBL889158 0.86 DNM1 (0.46) DNM1DGKAMAPTADRA2AADRA1A
SCHEMBL12792545 0.86 NAAA (0.53) DNM1DGKAMGLLHTR2CTHRA
SCHEMBL25801067 0.86 NAAA (0.53) DNM1DGKAMGLLHTR2CTHRA
SCHEMBL10820524 0.86 NAAA (0.53) DNM1DGKAMGLLHTR2CTHRA

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-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-01-12 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-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE FCGRT, MYD88, C3AR1 DNM1 4279/4885DGKA 1291/4885MGLL 372/4885

“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.