SCHEMBL16057367

SCHEMBL16057367

O=C(Oc1ncccc1CCCCCc1ccccc1)Oc1ncccc1CCCCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BID P55957 1/20 0.47
BCL2L1 Q07817 1/20 0.47
MCL1 Q07820 1/20 0.47
BAK1 Q16611 1/20 0.47
DAGLA Q9Y4D2 7/20 0.46
MAPT P10636 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CES1 P23141 7/20 0.44
FAAH O00519 7/20 0.43
NCEH1 Q6PIU2 1/20 0.43
SLC13A5 Q86YT5 1/20 0.42
PTGER1 P34995 1/20 0.42
PTGER4 P35408 1/20 0.42
PTGER3 P43115 1/20 0.42
PTGER2 P43116 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
TBXAS1 P24557 2/20 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
SCHEMBL16056927 0.99 BID (0.44) BIDBCL2L1MCL1BAK1DAGLA
SCHEMBL16057401 0.96 PTGER1 (0.46) BIDBCL2L1MCL1BAK1DAGLA
SCHEMBL16057371 0.91 BID (0.47) BIDBCL2L1MCL1BAK1DAGLA
SCHEMBL16056930 0.90 BID (0.44) BIDBCL2L1MCL1BAK1DAGLA
SCHEMBL16058002 0.90 ABCB1 (0.47) SLC13A5ALDH1A1
SCHEMBL16057405 0.87 PTGER1 (0.46) BIDBCL2L1MCL1BAK1DAGLA
SCHEMBL16058085 0.86 SLC13A5 (0.40) MAPTSLC13A5ALDH1A1
SCHEMBL16056841 0.86 TBXAS1 (0.54) TBXAS1
SCHEMBL14975778 0.84 SLC13A5 (0.41) DAGLASLC13A5
SCHEMBL16057892 0.84 THRA (0.47) BIDBCL2L1MCL1BAK1MAPT

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-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 US disclosed
WO-2014144836-A2 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-18 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-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 BID 1720/4885BCL2L1 4484/4885MCL1 2993/4885

“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.