SCHEMBL21883219

SCHEMBL21883219

S=C(Nc1ccc(Cl)c(Cl)c1)n1cccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.51
PLAU P00749 1/20 0.51
KLKB1 P03952 1/20 0.51
ELANE P08246 1/20 0.51
LMNA P02545 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
IDO1 P14902 1/20 0.46
MAPT P10636 10/20 0.46
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.45
RAB9A P51151 2/20 0.45
ALDH1A1 P00352 6/20 0.44
GAA P10253 4/20 0.44
GRM4 Q14833 1/20 0.44
HPGD P15428 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.44
EPHX2 P34913 1/20 0.44
HTT P42858 1/20 0.43
HKDC1 Q2TB90 1/20 0.43

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
SCHEMBL21883217 0.84 FBP1 (0.47) F2PLAUKLKB1ELANELMNA
SCHEMBL21883137 0.83 SMN1; SMN2 (0.49) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL21883121 0.82 KMT2A (0.51) LMNASMN1; SMN2IDO1MAPTKMT2A
SCHEMBL18604415 0.78 ALDH1A1 (0.46) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL21883140 0.77 NPC1 (0.47) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL21883221 0.77 MAPT (0.46) F2PLAUKLKB1ELANELMNA
SCHEMBL21883142 0.77 SMN1; SMN2 (0.49) ELANELMNASMN1; SMN2IDO1MAPT
SCHEMBL21883243 0.77 TDP1 (0.47) LMNASMN1; SMN2IDO1MAPTKMT2A
SCHEMBL21883273 0.76 LMNA (0.51) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL21883224 0.75 RAB9A (0.54) LMNASMN1; SMN2MAPTKMT2AMEN1

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
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 F2 3320/4885PLAU 4376/4885KLKB1 4691/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 F2 4161/4885PLAU 4121/4885KLKB1 3576/4885

“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.