SCHEMBL3705986

SCHEMBL3705986

O=Cc1ccc(Cl)c(F)c1O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 11/20 0.48
TDP1 Q9NUW8 2/20 0.42
TLR2 O60603 1/20 0.36
TLR1 Q15399 1/20 0.36
TLR6 Q9Y2C9 1/20 0.36
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL14920117 0.83 ERN1 (0.44) ERN1TDP1TRIM24TRIM33ALDH1A1
SCHEMBL8608158 0.80 ERN1 (0.48) ERN1TDP1TLR2TLR1TLR6
SCHEMBL17842843 0.80 TDP1 (0.46) ERN1TDP1ALDH1A1MEN1LMNA
SCHEMBL29715811 0.78 ERN1 (0.63) ERN1
SCHEMBL658824 0.78 ERN1 (0.47) ERN1TDP1TLR2TLR1TLR6
SCHEMBL31114189 0.78 ERN1 (0.52) ERN1TLR2TLR1TLR6TRIM24
SCHEMBL12814036 0.78 ERN1 (0.52) ERN1TLR2TLR1TLR6TRIM24
SCHEMBL1042430 0.78 ERN1 (0.63) ERN1
SCHEMBL30207774 0.78 TDP1 (0.45) ERN1TDP1ALDH1A1MEN1LMNA
SCHEMBL20088344 0.78 TDP1 (0.45) ERN1TDP1ALDH1A1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002409-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS JANSSEN BIOPHARMA INC (US) 2023-01-05 US disclosed
US-11312727-B1 Macrocyclic flu endonuclease inhibitors Janssen Biopharma, Inc. (US) 2022-04-26 US disclosed
EP-3864020-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS Janssen BioPharma, Inc. (US) 2021-08-18 EP disclosed
EP-2200969-A2 NOVEL COMPOUNDS ACTIVE AS MUSCARINIC RECEPTOR ANTAGONISTS Pfizer Limited (GB) 2010-06-30 EP disclosed
WO-2009034432-A2 NOVEL COMPOUNDS ACTIVE AS MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 2009-03-19 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-20230002409-A1 MACROCYCLIC FLU ENDONUCLEASE INHIBITORS ACE, PNP, FEN1 ERN1 468/4885TDP1 133/4885TLR2 3367/4885
US-11312727-B1 Macrocyclic flu endonuclease inhibitors ACE, FEN1, PNP ERN1 543/4885TDP1 154/4885TLR2 3576/4885

“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.