SCHEMBL19681638

SCHEMBL19681638

CCCCCCCCC(O)CN(CCC(=O)NCCN(C)CCCS(=O)(=O)O)CCN(CCN(CC(O)CCCCCCCC)CC(O)CCCCCCCC)CCN(CC(O)CCCCCCCC)CC(O)CCCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.40
FAAH O00519 6/20 0.37
CASP2 P42575 1/20 0.36
NAAA Q02083 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
EPHX2 P34913 1/20 0.34
TLR2 O60603 1/20 0.33
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM4E B2RXH2 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
FFAR1 O14842 1/20 0.32

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
SCHEMBL19681584 0.89 DNM1 (0.39) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25681831 0.84 FAAH (0.36) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL19681640 0.84 DNM1 (0.35) DNM1CASP2NAAAEPHX2TLR2
SCHEMBL25963592 0.83 DNM1 (0.48) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL19681639 0.83 FAAH (0.47) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25964558 0.82 DNM1 (0.45) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25963506 0.81 DNM1 (0.47) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25963572 0.81 DNM1 (0.47) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25963546 0.81 DNM1 (0.47) DNM1FAAHCASP2NAAAL3MBTL1
SCHEMBL25963457 0.81 DNM1 (0.50) DNM1FAAHCASP2NAAAL3MBTL1

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-20170349543-A1 CATIONIC SULFONAMIDE AMINO LIPIDS AND AMPHIPHILIC ZWITTERIONIC AMINO LIPIDS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-12-07 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-20170349543-A1 CATIONIC SULFONAMIDE AMINO LIPIDS AND AMPHIPHILIC ZWITTERIONIC AMINO LIPIDS ABHD16A, AARS1, CFTR DNM1 700/4885FAAH 935/4885CASP2 2627/4885

“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.