SCHEMBL1364566

SCHEMBL1364566

CC(=O)C(C)C.N=C=O.N=C=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.30
NFKB1 P19838 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
SCHEMBL3226988 0.82
SCHEMBL5051122 0.82 LMNA (0.46) ALDH1A1TDP1TSHRLMNATP53
SCHEMBL24113 0.82
Acetone SCHEMBL9738904 0.78 LMNA (0.55) ALDH1A1TDP1TSHRLMNANFKB1
SCHEMBL3287296 0.78
Acetone SCHEMBL23501541 0.78
SCHEMBL3285880 0.78
Hydrochloric Acid SCHEMBL529345 0.78
Ammonia Solution, Strong SCHEMBL6841304 0.78
Water SCHEMBL6154387 0.78

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-20130005918-A1 METHOD FOR PRODUCING POLYMERIC POLYAMINES NATIONAL TAIWAN UNIVERSITY (TW) 2013-01-03 US claimed
US-20110288239-A1 POLYMERIC POLYAMINES AND METHOD FOR PRODUCING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2011-11-24 US claimed
US-20090149583-A1 POLYMERIC POLYAMINES AND METHOD FOR STABILIZING SILVER NANOPARTICLE BY EMPLOYING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2009-06-11 US claimed
US-20130005918-A1 METHOD FOR PRODUCING POLYMERIC POLYAMINES NATIONAL TAIWAN UNIVERSITY (TW) 2013-01-03 US disclosed
US-20110288239-A1 POLYMERIC POLYAMINES AND METHOD FOR PRODUCING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2011-11-24 US disclosed
US-8013048-B2 Polymeric polyamines and method for stabilizing silver nanoparticle by employing the same NATIONAL TAIWAN UNIVERSITY (TW) 2011-09-06 US disclosed
US-20090149583-A1 POLYMERIC POLYAMINES AND METHOD FOR STABILIZING SILVER NANOPARTICLE BY EMPLOYING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2009-06-11 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 (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-20130005918-A1 METHOD FOR PRODUCING POLYMERIC POLYAMINES SRM, PARN, SMS ALDH1A1 867/4885TDP1 2336/4885TSHR 3413/4885
US-20110288239-A1 POLYMERIC POLYAMINES AND METHOD FOR PRODUCING THE SAME SRM, SMS, SMN1; SMN2 ALDH1A1 768/4885TDP1 422/4885TSHR 4594/4885

“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.