SCHEMBL15044554

SCHEMBL15044554

C=CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
TDP1 Q9NUW8 3/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
FAAH O00519 4/20 0.37
TGM2 P21980 2/20 0.35
POLB P06746 2/20 0.35
ALOX15 P16050 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
APEX1 P27695 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL23870420 1.00 ALDH1A1 (0.50) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL11141754 1.00 ALDH1A1 (0.50) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL28715 0.91
SCHEMBL8497674 0.89 ALDH1A1 (0.56) ALDH1A1TDP1TSHRMAPK1ZDHHC20
Acrylic Acid SCHEMBL10595974 0.86 ALDH1A1 (0.54) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL12849273 0.81 TSHR (0.48) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL326232 0.79 TSHR (0.46) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL28616756 0.79 TSHR (0.46) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL8376831 0.78 TSHR (0.50) ALDH1A1TDP1TSHRMAPK1ZDHHC20
SCHEMBL19672582 0.78 ALDH1A1 (0.39) ALDH1A1TDP1FAAHPOLBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9289510-B2 Polymeric drug delivery conjugates and methods of making and using thereof UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-03-22 US disclosed
US-20130156722-A1 POLYMERIC DRUG DELIVERY CONJUGATES AND METHODS OF MAKING AND USING THEREOF UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-06-20 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-20130156722-A1 POLYMERIC DRUG DELIVERY CONJUGATES AND METHODS OF MAKING AND USING THEREOF CD44, MMP7, MMP26 ALDH1A1 779/4885TDP1 1716/4885TSHR 3870/4885

“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.