SCHEMBL23398356

SCHEMBL23398356

CCCCCCCCCCCCCCCCCCc1cc(N)ccc1S

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.44
TSHR P16473 2/20 0.44
HTR2A P28223 1/20 0.43
GPR84 Q9NQS5 1/20 0.42
SRC P12931 1/20 0.42
MAPT P10636 2/20 0.42
TYR P14679 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX5 P09917 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LIPG Q9Y5X9 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL23398359 1.00 TLR8 (0.44) TLR8TSHRHTR2AGPR84SRC
SCHEMBL207523 0.81 HTR2A (0.46) TLR8TSHRHTR2AGPR84SRC
SCHEMBL1971171 0.81 TYR (0.44) TLR8TSHRHTR2AMAPTTYR
SCHEMBL1969918 0.81 TYR (0.44) TLR8TSHRHTR2AMAPTTYR
SCHEMBL1971686 0.81 TYR (0.44) TLR8TSHRHTR2AMAPTTYR
SCHEMBL2018932 0.81 HTR2A (0.46) TLR8TSHRHTR2AGPR84SRC
SCHEMBL12798389 0.81 HTR2A (0.46) TLR8TSHRHTR2AGPR84SRC
SCHEMBL10345219 0.81 HTR2A (0.46) TLR8TSHRHTR2AGPR84SRC
SCHEMBL5377545 0.81 MAPT (0.49) TLR8TSHRHTR2AGPR84SRC
SCHEMBL27796305 0.81 HTR2A (0.46) TLR8TSHRHTR2AGPR84SRC

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220387369-A1 Prooxidative chain-transfer agents for use in the treatment of malignant tumour or infectious diseases UNIVERSITÄTSMEDIZIN DER JOHANNES GUTENBERG-UNIVERSITÄT MAINZ (DE) 2022-12-08 US claimed
EP-4065095-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES Universitätsmedizin der Johannes Gutenberg-Universität Mainz (DE) 2022-10-05 EP claimed
WO-2021105435-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES UNIVERSITÄTSMEDIZIN DER JOHANNES GUTENBERG-UNIVERSITÄT MAINZ (DE) 2021-06-03 WO claimed
EP-3827816-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES Universitätsmedizin der Johannes Gutenberg-Universität Mainz (DE) 2021-06-02 EP claimed
US-20220387369-A1 Prooxidative chain-transfer agents for use in the treatment of malignant tumour or infectious diseases UNIVERSITÄTSMEDIZIN DER JOHANNES GUTENBERG-UNIVERSITÄT MAINZ (DE) 2022-12-08 US disclosed
EP-4065095-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES Universitätsmedizin der Johannes Gutenberg-Universität Mainz (DE) 2022-10-05 EP disclosed
WO-2021105435-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES UNIVERSITÄTSMEDIZIN DER JOHANNES GUTENBERG-UNIVERSITÄT MAINZ (DE) 2021-06-03 WO disclosed
EP-3827816-A1 PROOXIDATIVE CHAIN-TRANSFER AGENTS FOR USE IN THE TREATMENT OF MALIGNANT TUMOUR OR INFECTIOUS DISEASES Universitätsmedizin der Johannes Gutenberg-Universität Mainz (DE) 2021-06-02 EP 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-20220387369-A1 Prooxidative chain-transfer agents for use in the treatment of malignant tumour or infectious diseases SLC25A1, SLC19A2, SLC25A21 TLR8 775/4885TSHR 1203/4885HTR2A 4539/4885

“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.