SCHEMBL2003100

SCHEMBL2003100

COc1ccc(S(=O)(=O)N(C)CCN(C)c2nc(Cc3ccc(Cl)cc3)ns2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.41
CXCR3 P49682 1/20 0.40
PTGER1 P34995 1/20 0.40
ALDH1A1 P00352 1/20 0.40
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
STAT3 P40763 1/20 0.39
CA2 P00918 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 1/20 0.39
PSEN1 P49768 2/20 0.38
PSEN2 P49810 2/20 0.38
APH1B Q8WW43 2/20 0.38
NCSTN Q92542 2/20 0.38
APH1A Q96BI3 2/20 0.38
PSENEN Q9NZ42 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 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
SCHEMBL1020162 0.95 NOS2 (0.40) ALDH1A1MMP9MAPTSMN1; SMN2NOS2
SCHEMBL2007365 0.91 LMNA (0.45) CNR2PTGER1ALDH1A1EGFRMAPT
SCHEMBL2012105 0.90 TAS2R14 (0.41) ALDH1A1EGFRERBB2MMP2MMP9
SCHEMBL1022400 0.90 ALDH1A1 (0.40) CNR2CXCR3ALDH1A1POLB
SCHEMBL1019577 0.86 ALDH1A1 (0.38) ALDH1A1MMP9MAPTSMN1; SMN2NOS2
SCHEMBL1020152 0.85 MEN1 (0.48) ALDH1A1EGFRERBB2CA1SMN1; SMN2
SCHEMBL1020526 0.85 BMP1 (0.41) ALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL2005838 0.84 MAPT (0.46) ALDH1A1MAPTSMN1; SMN2TP53POLB
SCHEMBL2002634 0.83 MGAT3 (0.42) ALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL1021501 0.83 CA1 (0.41) CNR2CXCR3PTGER1ALDH1A1EGFR

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-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US 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
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 CNR2 3443/4885CXCR3 4088/4885PTGER1 854/4885

“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.