SCHEMBL3011629

SCHEMBL3011629

CCc1ccc(Cc2csc(N3CCN(S(=O)(=O)c4c(C)cc(C)cc4C)CC3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.43
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 4/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 3/20 0.42
MAPK1 P28482 2/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
EBP Q15125 1/20 0.39
DHCR7 Q9UBM7 1/20 0.39
NPC1 O15118 1/20 0.38
THRB P10828 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL2999629 0.94 NPSR1 (0.45) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3008601 0.92 ALDH1A1 (0.42) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3008378 0.91 EPHX2 (0.47) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3016140 0.91 EBP (0.48) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3016674 0.90 NPSR1 (0.43) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3022401 0.90 KMT2A (0.45) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3020021 0.89 NPSR1 (0.47) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3008304 0.89 LMNA (0.48) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3651586 0.89 MEN1 (0.43) NPSR1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL3012685 0.89 KMT2A (0.45) NPSR1ALDH1A1KMT2AKDM4EMEN1

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 NPSR1 764/4885ALDH1A1 3510/4885KMT2A 2680/4885

“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.