SCHEMBL19856463

SCHEMBL19856463

C[C@H]1CC(C)(C)NCCN[C@@H](C)CC(C)(C)NCCN1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 1.00
ALDH1A1 P00352 1/20 0.31
MAPT P10636 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
SCHEMBL1955811 1.00 ALPL (1.00) ALPLALDH1A1MAPT
SCHEMBL12798377 1.00 ALPL (1.00) ALPLALDH1A1MAPT
SCHEMBL1172798 1.00 ALPL (1.00) ALPLALDH1A1MAPT
SCHEMBL1702315 1.00 ALPL (1.00) ALPLALDH1A1MAPT
SCHEMBL28791223 0.97 ALPL (0.95) ALPL
SCHEMBL29926982 0.97 ALPL (0.95) ALPL
SCHEMBL13768792 0.85 ALPL (0.73) ALPL
SCHEMBL11604064 0.85 ALPL (0.74) ALPL
SCHEMBL12475100 0.84 ALPL (0.70) ALPL
SCHEMBL10848773 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180369428-A1 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE KYUNGPOOK NATIONAL UNIVERSITY INDUSTRY- ACADEMIC COOPERATION FOUNDATION (KR) 2018-12-27 US claimed
EP-3281643-A2 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE Kyungpook National University Industry-Academic Cooperation Foundation (KR) 2018-02-14 EP claimed
US-20200138982-A1 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE KYUNGPOOK NATIONAL UNIVERSITY INDUSTRY- ACADEMIC COOPERATION FOUNDATION (KR) 2020-05-07 US disclosed
US-10583206-B2 Radioactive probe for detecting hydrogen sulfide Kyungpook National University Industry-Academic, Cooperation Foundation (KR) 2020-03-10 US disclosed
US-20180369428-A1 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE KYUNGPOOK NATIONAL UNIVERSITY INDUSTRY- ACADEMIC COOPERATION FOUNDATION (KR) 2018-12-27 US disclosed
EP-3281643-A2 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE Kyungpook National University Industry-Academic Cooperation Foundation (KR) 2018-02-14 EP 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 (3 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-20180369428-A1 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE TST, CTH, CBS ALPL 739/4885ALDH1A1 1035/4885MAPT 3502/4885
US-20200138982-A1 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE TST, SCLY, CTH ALPL 595/4885ALDH1A1 1070/4885MAPT 3370/4885
US-10583206-B2 Radioactive probe for detecting hydrogen sulfide TST, SCLY, CTH ALPL 595/4885ALDH1A1 1070/4885MAPT 3370/4885

“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.