SCHEMBL17124702

SCHEMBL17124702

COC(=O)C(C(C)C)C(C(=O)O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
CA14 Q9ULX7 3/20 0.40
CA12 O43570 2/20 0.40
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
SLC7A5 Q01650 1/20 0.35
MME P08473 2/20 0.34
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL15015776 1.00 SMN1; SMN2 (0.50) SMN1; SMN2CA14CA12KMT2ATP53
SCHEMBL561667 0.89 SMN1; SMN2 (0.60) SMN1; SMN2CA14CA12KMT2ACA7
SCHEMBL5512536 0.84 SMN1; SMN2 (0.60) SMN1; SMN2CA14CA12KMT2ACA7
SCHEMBL5328441 0.83 SMN1; SMN2 (0.61) SMN1; SMN2CA14CA12KMT2ATP53
SCHEMBL5328444 0.83 SMN1; SMN2 (0.61) SMN1; SMN2CA14CA12KMT2ATP53
SCHEMBL16438180 0.81 TP53 (0.50) TP53SLC7A5FPR1FPR2ALDH1A1
SCHEMBL659817 0.81 TP53 (0.50) TP53SLC7A5FPR1FPR2ALDH1A1
SCHEMBL15015930 0.78 TSHR (0.40) SMN1; SMN2CA14CA12TP53SLC7A5
SCHEMBL17124707 0.78 TSHR (0.40) SMN1; SMN2CA14CA12TP53SLC7A5
SCHEMBL14571319 0.78 SMN1; SMN2 (0.48) SMN1; SMN2CA14CA12KMT2ACA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148524-A1 TACKIFIER COMPOUNDS AND METHODS OF USING THE SAME IOWA STATE UNIV RESEACH FOUNDATION INC (US) 2018-05-31 US disclosed
US-9920145-B2 Tackifier compounds and methods of using the same IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2018-03-20 US disclosed
US-20170226243-A1 TACKIFIER COMPOUNDS AND METHODS OF USING THE SAME UNIV IOWA STATE RES FOUND INC (US) 2017-08-10 US disclosed
US-9688794-B2 Tackifier compounds and methods of using the same IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2017-06-27 US disclosed
US-20150274861-A1 TACKIFIER COMPOUNDS AND METHODS OF USING THE SAME IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2015-10-01 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-20150274861-A1 TACKIFIER COMPOUNDS AND METHODS OF USING THE SAME ORC3, OR10J3, NR2C2 SMN1; SMN2 2964/4885CA14 1164/4885CA12 314/4885

“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.