SCHEMBL21883224

SCHEMBL21883224

S=C(Nc1ccc(Cl)cc1Cl)n1cccn1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
LMNA P02545 7/20 0.52
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 2/20 0.49
HTT P42858 2/20 0.48
KMT2A Q03164 4/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.44
MCL1 Q07820 1/20 0.44

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
SCHEMBL21883273 0.84 LMNA (0.51) RAB9ANPC1LMNAALDH1A1SMN1; SMN2
SCHEMBL21883137 0.79 SMN1; SMN2 (0.49) RAB9ANPC1LMNAALDH1A1SMN1; SMN2
SCHEMBL21883121 0.78 KMT2A (0.51) RAB9ANPC1LMNAALDH1A1SMN1; SMN2
SCHEMBL21883267 0.78 ALDH1A1 (0.49) LMNAALDH1A1HPGDKMT2AMAPT
SCHEMBL21883118 0.76 NPC1 (0.52) RAB9ANPC1LMNAALDH1A1SMN1; SMN2
SCHEMBL21883221 0.76 MAPT (0.46) LMNASMN1; SMN2HPGDKMT2AMAPT
SCHEMBL21883219 0.75 F2 (0.51) RAB9ALMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL21883217 0.73 FBP1 (0.47) LMNAALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL31388374 0.70 ALDH1A1 (0.82) RAB9ANPC1LMNAALDH1A1SMN1; SMN2
SCHEMBL18604415 0.70 ALDH1A1 (0.46) RAB9ANPC1LMNAALDH1A1SMN1; 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 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 RAB9A 1761/4885NPC1 221/4885LMNA 4549/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 RAB9A 1707/4885NPC1 438/4885LMNA 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.