SCHEMBL13291369

SCHEMBL13291369

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nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 3/20 0.41
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.37
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32
CYP2C9 P11712 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
SNCA P37840 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
SCHEMBL16429694 0.84 TDP1 (0.44) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL15443236 0.82 TDP1 (0.46) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL19105443 0.82 TDP1 (0.46) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL6476278 0.81 TDP1 (0.48) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL536216 0.81
SCHEMBL12191482 0.80 TDP1 (0.44) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL2497807 0.80 TDP1 (0.44) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL24579861 0.79 TDP1 (0.41) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL6368830 0.79 TDP1 (0.41) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL9803733 0.79 TDP1 (0.41) TDP1TSHRCYP3A4MAPTCACNA1B

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-7737114-B2 Didemnin analogs and fragments and methods of making and using them THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-06-15 US disclosed
US-20070111928-A1 Didemnin analogs and fragments and methods of making and using them THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-05-17 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-20070111928-A1 Didemnin analogs and fragments and methods of making and using them BAD, MDN1, HDGF TDP1 2767/4885TSHR 4283/4885CYP3A4 4383/4885

“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.