SCHEMBL2735586

SCHEMBL2735586

CCC(=O)CNCC(=O)CC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 3/20 0.39
FFAR3 O14843 1/20 0.39
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
SOAT1 P35610 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL12707168 0.89 TDP1 (0.45) TDP1ALDH1A1FFAR3MGAMGAA
SCHEMBL14536188 0.89 TDP1 (0.45) TDP1ALDH1A1FFAR3MEN1KMT2A
SCHEMBL12035873 0.88
SCHEMBL20438307 0.84 TDP1 (0.41) TDP1
SCHEMBL17875398 0.83
SCHEMBL22872255 0.83 TDP1 (0.39) TDP1ALDH1A1GAA
SCHEMBL18929522 0.81
SCHEMBL22415486 0.79 TDP1 (0.36) TDP1
SCHEMBL22336404 0.79 GAA (0.50) TDP1ALDH1A1GAATSHR
SCHEMBL14577056 0.79 TDP1 (0.41) TDP1ALDH1A1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470964-B2 Peptides derived from NCAM (FGLs) ENKAM PHARMACEUTICALS A/S (DK) 2013-06-25 US disclosed
US-20120115796-A1 Novel Spacer Moiety for Poly(ehtylene Glycol) Modified Peptide Based Compounds AFFYMAX, INC. (US) 2012-05-10 US disclosed
US-20120115796-A1 Novel Spacer Moiety for Poly(ehtylene Glycol) Modified Peptide Based Compounds AFFYMAX, INC. (US) 2012-05-10 US disclosed
US-8088884-B2 Multi-armed forms of activated polyoxazoline and methods of synthesis thereof SERINA THERAPEUTICS, INC. (US) 2012-01-03 US disclosed
US-20100249368-A1 Multi-Armed Forms of Activated Polyoxazoline and Methods of Synthesis Thereof SERINA THERAPEUTICS, INC. (US) 2010-09-30 US disclosed
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus MITSUI CHEMICALS, INC. (JP) 2006-04-27 US disclosed
EP-1484191-A1 REWRITABLE OPTICAL INFORMATION RECORDING MEDIUM AND RECORDING/REPRODUCING METHOD, RECORDING/REPRODUCING DEVICE Sony Corporation (JP) 2004-12-08 EP 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 (2 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-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus ALPG, TRPC6, GNRHR TDP1 316/4885ALDH1A1 2071/4885FFAR3 2985/4885
US-20120115796-A1 Novel Spacer Moiety for Poly(ehtylene Glycol) Modified Peptide Based Compounds NGLY1, HM13, YWHAZ TDP1 4525/4885ALDH1A1 4441/4885FFAR3 3823/4885

“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.