SCHEMBL3012972

SCHEMBL3012972

Cc1cc(C)c(Cc2csc(N3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)n2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
HTT P42858 1/20 0.50
HSD11B1 P28845 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GBA1 P04062 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 2/20 0.43
PKLR P30613 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 2/20 0.41

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
SCHEMBL3011975 0.95 POLB (0.55) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3007146 0.90 POLB (0.52) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3652470 0.89 POLB (0.45) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3009537 0.88 POLB (0.52) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3018202 0.88 RAB9A (0.46) POLBHTTGBA1SMN1; SMN2PKM
SCHEMBL3018201 0.88 POLB (0.52) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3010293 0.88 POLB (0.51) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3005875 0.88 POLB (0.54) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL3010163 0.87 POLB (0.53) POLBHTTHSD11B1KDM4EGBA1
SCHEMBL2998720 0.87 POLB (0.53) POLBHTTHSD11B1KDM4EGBA1

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 POLB 4649/4885HTT 2/4885HSD11B1 1034/4885

“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.