SCHEMBL3003729

SCHEMBL3003729

O=S(=O)(c1ccc(F)cc1)N1CCN(c2nc(Cc3ccc(Cl)cc3Cl)cs2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
GBA1 P04062 3/20 0.50
MAPT P10636 3/20 0.50
USP2 O75604 1/20 0.50
RECQL P46063 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 2/20 0.46
PKM P14618 2/20 0.46
MAPK1 P28482 2/20 0.43
EPHX2 P34913 1/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 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
SCHEMBL3002640 0.94 POLB (0.52) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3012544 0.91 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3013317 0.90 NPSR1 (0.51) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3010912 0.90 POLB (0.46) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3006402 0.89 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3008163 0.89 POLB (0.45) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3004828 0.89 POLB (0.44) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3009212 0.88 POLB (0.45) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3014669 0.88 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT
SCHEMBL3018793 0.88 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2L3MBTL1GBA1MAPT

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.