SCHEMBL3010711

SCHEMBL3010711

Cc1ccccc1Cc1csc(N2CCC(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
ACHE P22303 1/20 0.37
FKBP1A P62942 1/20 0.37
MAPT P10636 4/20 0.37
DNM1L O00429 1/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
GBA1 P04062 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
SCHEMBL3007070 0.94 MEN1 (0.38) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3020138 0.92 KMT2A (0.37) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3019874 0.91 KMT2A (0.39) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3008969 0.91 MEN1 (0.39) KMT2AMEN1SMN1; SMN2MAPTDNM1L
SCHEMBL3006954 0.89 MAPK1 (0.39) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3013042 0.88 KMT2A (0.38) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL2997895 0.88 ALDH1A1 (0.41) KMT2AMEN1SMN1; SMN2ACHEMAPT
SCHEMBL3005449 0.87 KMT2A (0.38) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3015659 0.87 KMT2A (0.39) KMT2AMEN1SMN1; SMN2ACHEFKBP1A
SCHEMBL3009102 0.87 KMT2A (0.40) KMT2AMEN1SMN1; SMN2ACHEFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA KMT2A 2680/4885MEN1 454/4885SMN1; SMN2 1/4885

“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.