SCHEMBL3014974

SCHEMBL3014974

CCCc1ccc(-c2csc(N3CCN(S(=O)(=O)c4cc(Cl)ccc4OC)CC3)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
MAPT P10636 7/20 0.49
LMNA P02545 6/20 0.49
TSHR P16473 2/20 0.49
ALDH1A1 P00352 4/20 0.49
POLB P06746 2/20 0.49
RAB9A P51151 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
USP2 O75604 1/20 0.45
RECQL P46063 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL3014794 0.93 CYP3A4 (0.52) CYP3A4CYP2C19MAPTLMNATSHR
SCHEMBL3011380 0.91 ALDH1A1 (0.57) CYP3A4CYP2C19MAPTLMNATSHR
SCHEMBL3017612 0.90 ALDH1A1 (0.52) MAPTLMNAALDH1A1POLBRAB9A
SCHEMBL3009063 0.90 LMNA (0.53) MAPTLMNATSHRALDH1A1POLB
SCHEMBL3014597 0.90 GAA (0.49) MAPTLMNATSHRALDH1A1POLB
SCHEMBL3009587 0.88 POLB (0.56) CYP3A4CYP2C19MAPTLMNATSHR
SCHEMBL3019100 0.88 LMNA (0.53) MAPTLMNATSHRALDH1A1POLB
SCHEMBL3010848 0.88 ALDH1A1 (0.54) CYP3A4CYP2C19MAPTLMNATSHR
SCHEMBL3017691 0.88 CYP3A4 (0.52) CYP3A4CYP2C19MAPTLMNATSHR
SCHEMBL3011250 0.88 LMNA (0.53) CYP3A4CYP2C19MAPTLMNATSHR

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 CYP3A4 4794/4885CYP2C19 4845/4885MAPT 18/4885

“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.