SCHEMBL3013874

SCHEMBL3013874

COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4ccc(C)cc4)cs3)CC2)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.61
ALDH1A1 P00352 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
MAPT P10636 3/20 0.57
HSD17B10 Q99714 3/20 0.57
LMNA P02545 3/20 0.57
HTT P42858 2/20 0.57
USP2 O75604 2/20 0.57
RECQL P46063 2/20 0.57
POLB P06746 2/20 0.56
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54

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
SCHEMBL3019342 0.94 MAPT (0.62) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3002428 0.93 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3012467 0.92 MAPT (0.57) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3012210 0.92 POLB (0.66) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3020211 0.91 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3009640 0.91 MAPT (0.63) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3014481 0.90 MAPT (0.58) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3017141 0.89 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL3009444 0.89 MAPT (0.64) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL2998610 0.88 MAPT (0.58) SMN1; SMN2ALDH1A1L3MBTL1MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188272-B1 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2016-02-24 EP disclosed
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 SMN1; SMN2 1/4885ALDH1A1 3510/4885L3MBTL1 1847/4885

“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.