SCHEMBL19784466

SCHEMBL19784466

NCC1CC[C@@H](C(=O)O)O1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.40
SLC6A4 P31645 7/20 0.40
SLC6A3 Q01959 7/20 0.40
LMNA P02545 2/20 0.39
PLG P00747 1/20 0.39
PLAT P00750 1/20 0.39
GABRR1 P24046 4/20 0.35
GABRR2 P28476 1/20 0.35
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
PMP22 Q01453 1/20 0.33
TFPI2 P48307 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33
CYP2D6 P10635 1/20 0.32
HRH4 Q9H3N8 4/20 0.32
HRH3 Q9Y5N1 4/20 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
SCHEMBL18820209 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3LMNAPLG
SCHEMBL18820225 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3LMNAPLG
SCHEMBL15864539 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3LMNAPLG
SCHEMBL18356346 0.85 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3LMNAPLG
SCHEMBL22942134 0.80 PMP22 (0.34) LMNAKDM4EGMNNPMP22TFPI2
SCHEMBL17916936 0.80 PMP22 (0.34) LMNAKDM4EGMNNPMP22TFPI2
SCHEMBL17279186 0.79 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3HRH4HRH3
SCHEMBL20908638 0.78 KDM4E (0.33) LMNAKDM4EGMNNPMP22TFPI2
SCHEMBL11847024 0.78 CYP1A2 (0.34) LMNAGABRR1KDM4EGMNNPMP22
SCHEMBL21951861 0.78 PPM1B (0.34) LMNAKDM4EGMNNPMP22TFPI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10683327-B2 Compounds, linker-drugs and ligand-drug conjugates INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2020-06-16 US disclosed
US-20190106459-A1 COMPOUNDS, LINKER-DRUGS AND LIGAND-DRUG CONJUGATES INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-04-11 US disclosed
US-10233212-B2 Compounds, linker-drugs and ligand-drug conjugates INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-03-19 US disclosed
US-20180016300-A1 COMPOUNDS, LINKER-DRUGS AND LIGAND-DRUG CONJUGATES INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2018-01-18 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 (4 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-20180016300-A1 COMPOUNDS, LINKER-DRUGS AND LIGAND-DRUG CONJUGATES SLC43A1, HCAR3, SLC7A1 SLC6A2 194/4885SLC6A4 567/4885SLC6A3 95/4885
US-10683327-B2 Compounds, linker-drugs and ligand-drug conjugates SLC43A1, HCAR3, SLC7A1 SLC6A2 194/4885SLC6A4 567/4885SLC6A3 95/4885
US-10233212-B2 Compounds, linker-drugs and ligand-drug conjugates SLC43A1, HCAR3, SLC7A1 SLC6A2 194/4885SLC6A4 567/4885SLC6A3 95/4885
US-20190106459-A1 COMPOUNDS, LINKER-DRUGS AND LIGAND-DRUG CONJUGATES SLC43A1, HCAR3, SLC7A1 SLC6A2 194/4885SLC6A4 567/4885SLC6A3 95/4885

“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.