SCHEMBL18848342

SCHEMBL18848342

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nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 2/20 0.34
CA12 O43570 2/20 0.34
CA6 P23280 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
CA14 Q9ULX7 2/20 0.34
CA5B Q9Y2D0 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
TP53 P04637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32

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
SCHEMBL18848244 1.00 LMNA (0.34) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848238 1.00 LMNA (0.34) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848359 0.92 CHRNB2 (0.36) LMNAALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL18848231 0.92 CHRNB2 (0.36) LMNAALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL18848273 0.92 CHRNB2 (0.36) LMNAALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL18848343 0.86 CA12 (0.35) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848243 0.86 CA12 (0.35) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848236 0.86 CA12 (0.35) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848242 0.83 ALDH1A1 (0.34) LMNATDP1ALDH1A1ALOX15CA12
SCHEMBL18848344 0.83 ALDH1A1 (0.34) LMNATDP1ALDH1A1ALOX15CA12

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-9738620-B2 Trientine prodrugs, pharmaceutical compositions thereof, and methods of use Nguyen, Mark Quang (US) 2017-08-22 US disclosed
US-20170129868-A1 TRIENTINE PRODRUGS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-05-11 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 (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-20170129868-A1 TRIENTINE PRODRUGS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE SLC10A1, ABCB11, SLC10A2 LMNA 1764/4885TDP1 1180/4885ALDH1A1 688/4885

“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.