SCHEMBL21807645

SCHEMBL21807645

COC(=O)c1ccn(C(=S)Nc2ccc(Cl)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 1/20 0.47
NPC1 O15118 4/20 0.45
LMNA P02545 4/20 0.45
ALOX15 P16050 2/20 0.42
RAB9A P51151 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
EPHX1 P07099 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C19 P33261 2/20 0.40
PKM P14618 1/20 0.40
CYP2C9 P11712 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL21883159 0.88 EGFR (0.54) MAPTGAAHPGDNPC1LMNA
SCHEMBL32665830 0.85 NPC1 (0.51) MAPTGAAHPGDNPC1LMNA
SCHEMBL21883132 0.85 NPC1 (0.51) MAPTGAAHPGDNPC1LMNA
SCHEMBL24221964 0.84 SMN1; SMN2 (0.47) MAPTGAAHPGDNPC1LMNA
SCHEMBL21883161 0.80 KMT2A (0.51) MAPTHPGDNPC1LMNAALOX15
SCHEMBL21883512 0.77 PLAU (0.48) MAPTGAANPC1LMNAKMT2A
SCHEMBL21883139 0.75 SMN1; SMN2 (0.47) MAPTGAANPC1LMNARAB9A
SCHEMBL21883160 0.74 POLB (0.55) MAPTHPGDNPC1LMNARAB9A
SCHEMBL32665832 0.74 POLB (0.55) MAPTHPGDNPC1LMNARAB9A
SCHEMBL21883129 0.74 MEN1 (0.46) MAPTGAANPC1LMNARAB9A

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-12534440-B2 Compounds with copper- or zinc-activated toxicity against microbial infection KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2026-01-27 US disclosed
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION THE UAB RESEARCH FOUNDATION 2022-01-27 US disclosed
WO-2020061412-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2020-03-26 WO disclosed
WO-2020061412-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2020-03-26 WO 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 (2 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-12534440-B2 Compounds with copper- or zinc-activated toxicity against microbial infection TST, SLC39A11, SLC39A3 MAPT 1521/4885GAA 2353/4885HPGD 2107/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 MAPT 2375/4885GAA 2388/4885HPGD 1560/4885

“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.