SCHEMBL5990174

SCHEMBL5990174

CCCCCCCC/C=C\CCCCCCCCOC(=O)CN1CCN(C)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.52
THRB P10828 2/20 0.45
THRA P10827 1/20 0.45
NAAA Q02083 1/20 0.45
MGLL Q99685 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
CNR1 P21554 1/20 0.43
EPHX2 P34913 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 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
Cadaverine Tartrate SCHEMBL5987469 0.92 FAAH (0.45) FAAHTHRBTHRANAAAMGLL
SCHEMBL13601609 0.92 NAAA (0.53) FAAHTHRBTHRANAAAALDH1A1
SCHEMBL6476420 0.92 NAAA (0.53) FAAHTHRBTHRANAAAALDH1A1
SCHEMBL10852328 0.85 THRA (0.47) THRBTHRANAAAALDH1A1MAPT
SCHEMBL11855822 0.85 NAAA (0.60) FAAHTHRBTHRANAAAALDH1A1
SCHEMBL4264512 0.85 FAAH (0.51) FAAHTHRBNAAAMGLLALDH1A1
Cadaverine Tartrate SCHEMBL5986724 0.83 THRA (0.44) FAAHTHRBTHRANAAAALDH1A1
SCHEMBL15847993 0.81 EPHX2 (0.50) FAAHTHRBTHRAMGLLALDH1A1
SCHEMBL15847974 0.81 EPHX2 (0.50) FAAHTHRBTHRAMGLLALDH1A1
SCHEMBL18300082 0.81 EPHX2 (0.50) FAAHTHRBTHRAMGLLALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987263-B2 Basic esters of fatty alcohols and their use as anti-inflammatory or immunomodulatory agents YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2015-03-24 US disclosed
US-20060173053-A1 Basic esters of fatty alcohols and their use as anti-inflammatory or immunomodulatory agents YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2006-08-03 US disclosed
EP-1551495-A2 BASIC ESTERS OF FATTY ALCOHOLS AND THEIR USE AS ANTI-INFLAMMATORY OR IMMUNOMODULATORY AGENTS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2005-07-13 EP disclosed
WO-2004032824-A2 BASIC ESTERS OF FATTY ALCOHOLS AND THEIR USE AS ANTI-INFLAMMATORY OR IMMUNOMODULATORY AGENTS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2004-04-22 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-20060173053-A1 Basic esters of fatty alcohols and their use as anti-inflammatory or immunomodulatory agents ALOX12, ALOX15, ALOX15B FAAH 117/4885THRB 1195/4885THRA 829/4885

“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.