SCHEMBL21807618

SCHEMBL21807618

NC(=S)Sc1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.44
▸ IDO1 P14902 3/20 0.43
▸ TERT O14746 1/20 0.38
▸ LMNA P02545 4/20 0.38
▸ TSHR P16473 2/20 0.38
▸ HTR3E A5X5Y0 1/20 0.38
▸ HTR3B O95264 1/20 0.38
▸ HTR3A P46098 1/20 0.38
▸ HTR3D Q70Z44 1/20 0.38
▸ HTR3C Q8WXA8 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HTT P42858 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TAAR1 Q96RJ0 2/20 0.36
▸ LDHA P00338 1/20 0.35
▸ HAO1 Q9UJM8 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL32665831 0.83 TSHR (0.40) PKMIDO1LMNATSHRHTR3A
SCHEMBL7164239 0.80 IDO1 (0.49) PKMIDO1TERTLMNATSHR
SCHEMBL32665834 0.75 ITGB2 (0.47) IDO1TSHRALDH1A1MAPTHTT
SCHEMBL14919249 0.74 MAPT (0.41) TSHRHTR3AALDH1A1MAPTHAO1
SCHEMBL7628635 0.73 IDO1 (0.46) PKMIDO1TERTLMNATSHR
SCHEMBL30876196 0.72 MAPT (0.40) TSHRHTR3AALDH1A1MAPTHAO1
SCHEMBL2253699 0.72 MAPT (0.40) TSHRHTR3AALDH1A1MAPTHAO1
SCHEMBL28469527 0.70 CA12 (0.57) PKMIDO1TERTLMNATSHR
SCHEMBL28855119 0.69 CYP1A2 (0.50) LMNATSHRALDH1A1KDM4EMAPT
SCHEMBL1080945 0.69 ACHE (0.45) PKMLMNAALDH1A1MAPTHTT

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 3 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
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 PKM 2799/4885IDO1 2303/4885TERT 341/4885
US-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 PKM 4033/4885IDO1 1055/4885TERT 1760/4885

“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.

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