SCHEMBL21883155

SCHEMBL21883155

CN(C(=S)Nc1ccccc1Cl)c1ccn(C(=S)Nc2ccccc2Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 4/20 0.43
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
GAA P10253 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 2/20 0.38
TGFBR1 P36897 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL21883269 0.81 LMNA (0.49) RAB9ALMNAALDH1A1KMT2AMAPT
SCHEMBL21883152 0.77 ALDH1A1 (0.42) RAB9ALMNAALDH1A1KMT2AMAPT
SCHEMBL21883112 0.76 LMNA (0.49) RAB9AMAPK1LMNAALDH1A1KMT2A
SCHEMBL21883248 0.76 GAA (0.47) RAB9ALMNAALDH1A1KMT2AMAPT
SCHEMBL21883218 0.74 RAB9A (0.56) RAB9AMAPK1LMNAALDH1A1KMT2A
SCHEMBL21883127 0.73 RAB9A (0.49) RAB9ALMNAKMT2AMAPTSMN1; SMN2
SCHEMBL21883161 0.72 KMT2A (0.51) RAB9ALMNAALDH1A1KMT2AMAPT
SCHEMBL21883287 0.72 KMT2A (0.48) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL21883158 0.71 KMT2A (0.52) RAB9AMAPK1LMNAALDH1A1KMT2A
SCHEMBL21883273 0.70 LMNA (0.51) RAB9ALMNAALDH1A1KMT2AMAPT

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-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 (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-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 RAB9A 1707/4885MAPK1 1508/4885LMNA 4664/4885

“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.