SCHEMBL21883285

SCHEMBL21883285

FC(F)(F)c1ccn(C(=S)Nc2ccc(Cl)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 7/20 0.44
NPSR1 Q6W5P4 4/20 0.44
LMNA P02545 5/20 0.43
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 2/20 0.43
ORAI1 Q96D31 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 3/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.38
IGF1R P08069 1/20 0.38

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
SCHEMBL21883139 0.78 SMN1; SMN2 (0.47) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883512 0.78 PLAU (0.48) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883502 0.75 ALDH1A1 (0.46) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883129 0.74 MEN1 (0.46) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21807645 0.71 MAPT (0.47) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883152 0.71 ALDH1A1 (0.42) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883234 0.70 SMN1; SMN2 (0.49) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL21883137 0.70 SMN1; SMN2 (0.49) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL24221920 0.69 NPC1 (0.46) SMN1; SMN2MAPTNPSR1LMNAALDH1A1
SCHEMBL11239583 0.69 MAPT (0.52) SMN1; SMN2MAPTNPSR1LMNAALDH1A1

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 SMN1; SMN2 3367/4885MAPT 2375/4885NPSR1 3231/4885

“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.