SCHEMBL3053443

SCHEMBL3053443

O=C(Cl)c1ccc(Oc2ccccc2)o1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.52
MAPT P10636 4/20 0.48
ALDH1A1 P00352 3/20 0.48
KLKB1 P03952 1/20 0.43
MAPK1 P28482 2/20 0.43
FFAR1 O14842 1/20 0.42
SRD5A2 P31213 3/20 0.41
LTA4H P09960 2/20 0.40
TSHR P16473 2/20 0.39
FAAH O00519 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
PARP10 Q53GL7 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
SCHEMBL2851741 0.85 NPSR1 (0.51) NPSR1MAPTALDH1A1KLKB1FFAR1
SCHEMBL4155326 0.82 PARP10 (0.50) NPSR1MAPTALDH1A1KLKB1MAPK1
SCHEMBL14864597 0.82 NPSR1 (0.49) NPSR1MAPTALDH1A1KLKB1MAPK1
SCHEMBL3055351 0.81 TDP1 (0.44) NPSR1MAPTALDH1A1LMNA
SCHEMBL3061025 0.79 ALDH1A1 (0.68) NPSR1MAPTALDH1A1KLKB1MAPK1
SCHEMBL13687506 0.78 NPSR1 (0.46) NPSR1MAPTALDH1A1KLKB1MAPK1
SCHEMBL8782245 0.74 SMN1; SMN2 (0.56) NPSR1MAPTALDH1A1HPGD
SCHEMBL14339571 0.73 LMNA (0.62) NPSR1MAPTALDH1A1TSHRLMNA
SCHEMBL7070609 0.73 TDP1 (0.38) MAPTALDH1A1LMNAHPGDRAB9A
Diphenylether SCHEMBL7637273 0.71 LTA4H (0.67) FFAR1SRD5A2LTA4HTSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 US 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 (3 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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 NPSR1 1776/4885MAPT 9/4885ALDH1A1 1930/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 NPSR1 1776/4885MAPT 9/4885ALDH1A1 1930/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 NPSR1 1776/4885MAPT 9/4885ALDH1A1 1930/4885

“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.