SCHEMBL21883283

SCHEMBL21883283

Cc1ccn(C(=S)Nc2ccc(N=C=S)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 2/20 0.45
PLAU P00749 1/20 0.43
ELANE P08246 1/20 0.43
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 1/20 0.37
NOS1 P29475 1/20 0.36
CNR1 P21554 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
MIF P14174 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.31
TGFBR1 P36897 2/20 0.31

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
SCHEMBL21883144 0.84 P2RY6 (0.45) P2RY6CNR1ABCG2ALDH1A1MAPT
SCHEMBL21883512 0.79 PLAU (0.48) PLAUELANEKDM4EL3MBTL1TSHR
SCHEMBL21883274 0.77 P2RY6 (0.46) P2RY6L3MBTL1NOS1CNR1ABCG2
SCHEMBL21883284 0.75 PLAU (0.42) PLAUELANEKDM4EL3MBTL1TSHR
SCHEMBL22883166 0.71 P2RY6 (0.58) P2RY6NPC1RAB9AALDH1A1MAPT
SCHEMBL21883149 0.69 KMT2A (0.52) NPC1RAB9AMAPTLMNAGAA
SCHEMBL13498468 0.68 P2RY6 (0.64) P2RY6KDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL21807637 0.68 LMNA (0.42) PLAUELANEKDM4EL3MBTL1NOS1
SCHEMBL728602 0.68 P2RY6 (0.58) P2RY6TSHRALDH1A1MAPTMIF
SCHEMBL21883135 0.67 RAB9A (0.46) KDM4ENPC1RAB9AALDH1A1MAPT

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 P2RY6 4381/4885PLAU 4376/4885ELANE 39/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 P2RY6 3685/4885PLAU 4121/4885ELANE 43/4885

“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.