SCHEMBL2999500

SCHEMBL2999500

Cc1cc(C)cc(-c2csc(N3CCN(S(=O)(=O)c4c(C(C)C)cc(C(C)C)cc4C(C)C)CC3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.46
ALDH1A1 P00352 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 4/20 0.46
LMNA P02545 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 6/20 0.42
RECQL P46063 2/20 0.42
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
EPHX2 P34913 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37

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
SCHEMBL3017577 0.91 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3016451 0.90 MAPT (0.50) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3016861 0.89 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3018856 0.89 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3009218 0.89 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3021331 0.88 MAPK1 (0.62) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3002220 0.87 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3006977 0.87 MAPT (0.53) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3011298 0.86 MAPT (0.55) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL3014678 0.85 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1L3MBTL1MAPK1LMNA

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 5 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
EP-2188272-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV Remynd (BE) 2010-05-26 EP disclosed
WO-2009019295-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-12 WO 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.