SCHEMBL1018353

SCHEMBL1018353

COc1ccc(S(=O)(=O)NCC(C)Nc2nc(Cc3ccccc3F)ns2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
POLB P06746 3/20 0.40
HTR7 P34969 1/20 0.40
THRB P10828 1/20 0.40
MAPT P10636 4/20 0.39
TP53 P04637 1/20 0.38
LMNA P02545 2/20 0.37
PKM P14618 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
UBE2N P61088 1/20 0.37

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
SCHEMBL1020282 0.90 GAA (0.44) ALDH1A1POLBHTR7MAPTLMNA
SCHEMBL1020805 0.90 ALDH1A1 (0.41) ALDH1A1POLBMAPTTP53LMNA
SCHEMBL1019470 0.87 ALDH1A1 (0.50) ALDH1A1POLBMAPTLMNAPKM
SCHEMBL1021548 0.85 ALDH1A1 (0.45) ALDH1A1POLBLMNAPKM
SCHEMBL1018475 0.85 ALDH1A1 (0.50) ALDH1A1POLBHTR7MAPTTP53
SCHEMBL1022130 0.84 HTR7 (0.46) ALDH1A1POLBHTR7THRBMAPT
SCHEMBL1021100 0.84 CYP19A1 (0.44) ALDH1A1POLBMAPTTP53LMNA
SCHEMBL1019776 0.83 LMNA (0.41) ALDH1A1THRBMAPTTP53LMNA
SCHEMBL1019638 0.82 ALDH1A1 (0.40) ALDH1A1POLBTP53LMNAKMT2A
SCHEMBL1020769 0.82 CYP19A1 (0.47) ALDH1A1POLBHTR7THRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US claimed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP claimed
US-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2010-06-10 US claimed
US-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US disclosed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP disclosed
US-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2010-06-10 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 (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-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES SNCA, PARK7, PRNP ALDH1A1 608/4885POLB 2907/4885HTR7 2114/4885

“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.