SCHEMBL21883112

SCHEMBL21883112

Nc1ccn(C(=S)Nc2ccccc2Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 3/20 0.43
GAA P10253 2/20 0.43
POLB P06746 1/20 0.42
RAB9A P51151 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MIF P14174 1/20 0.41
NPC1 O15118 2/20 0.41
HTT P42858 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPKAPK2 P49137 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
SCHEMBL21883227 0.89 ALDH1A1 (0.50) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883233 0.84 GAA (0.38) LMNAMAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL21883118 0.83 NPC1 (0.52) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883269 0.82 LMNA (0.49) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883218 0.80 RAB9A (0.56) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883127 0.79 RAB9A (0.49) LMNAMAPTKMT2ASMN1; SMN2GAA
SCHEMBL21883504 0.76 RAB9A (0.35) LMNAMAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL21883139 0.76 SMN1; SMN2 (0.47) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883273 0.76 LMNA (0.51) LMNAMAPTALDH1A1KDM4EKMT2A
SCHEMBL21883225 0.75 IDO1 (0.49) LMNAMAPTALDH1A1KMT2ASMN1; SMN2

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 5 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 claimed
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
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

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 LMNA 4549/4885MAPT 1521/4885ALDH1A1 1604/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 LMNA 4664/4885MAPT 2375/4885ALDH1A1 2965/4885

“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.