SCHEMBL25319769

SCHEMBL25319769

COc1ccc(C2CN(C(=O)c3cc(F)c(O)c(C=O)c3)CCS2)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.40
PROKR1 Q8TCW9 4/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37
MYC P01106 1/20 0.36
CPS1 P31327 1/20 0.36
GRM3 Q14832 1/20 0.36
SLC18A3 Q16572 1/20 0.36

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
SCHEMBL29475543 1.00 ERN1 (0.40) ERN1PROKR1ALDH1A1LMNAHPGD
SCHEMBL30476673 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL29475596 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL25322131 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL25318324 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL29475564 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL25320430 0.85 ERN1 (0.42) ERN1ALDH1A1LMNAHPGD
SCHEMBL17040279 0.70 MAOA (0.44) LMNAHPGD
SCHEMBL25317544 0.69 ERN1 (0.47) ERN1PROKR1ALDH1A1LMNAHPGD
SCHEMBL29475606 0.69 ERN1 (0.47) ERN1PROKR1ALDH1A1LMNAHPGD

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-20240043395-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. 2024-02-08 US disclosed
EP-4217342-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING Neuropore Therapies, Inc. (US) 2023-08-02 EP disclosed
CN-116507607-A Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2023-07-28 CN 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-20240043395-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 ERN1 738/4885PROKR1 4708/4885ALDH1A1 4634/4885

“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.