SCHEMBL3017331

SCHEMBL3017331

O=S(=O)(c1ccc(F)cc1)N1CCN(c2nc(Cc3ccc(F)c(F)c3)cs2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MAPT P10636 3/20 0.51
USP2 O75604 1/20 0.51
RECQL P46063 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PKM P14618 4/20 0.47
MAPK1 P28482 2/20 0.44
LMNA P02545 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43

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
SCHEMBL3119908 0.93 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3012916 0.92 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3010528 0.92 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3012883 0.92 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3000017 0.92 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3015402 0.92 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3015337 0.90 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3649352 0.90 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3003000 0.89 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3005421 0.89 HSD11B1 (0.48) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2

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 ALDH1A1 3510/4885SMN1; SMN2 1/4885L3MBTL1 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.