SCHEMBL3011689

SCHEMBL3011689

Cc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(OC(F)(F)F)cc4)CC3)n2)cc1C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 2/20 0.37
AVPR1B P47901 1/20 0.37
KIT P10721 2/20 0.36
EPHX2 P34913 1/20 0.36
CHRM4 P08173 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
TRPM8 Q7Z2W7 6/20 0.34
HTR2A P28223 1/20 0.34
SCN9A Q15858 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34

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
SCHEMBL3016941 0.91 LIPE (0.44) LIPEAVPR1BEPHX2CHRM4TRPM8
SCHEMBL3016319 0.90 LIPE (0.40) LIPEAVPR1BKITEPHX2CHRM4
SCHEMBL3000034 0.90 AVPR1B (0.42) LIPEAVPR1BEPHX2CHRM4TRPM8
SCHEMBL3019380 0.89 LIPE (0.38) LIPEAVPR1BKITEPHX2CHRM4
SCHEMBL3006121 0.89 LIPE (0.36) LIPEAVPR1BEPHX2CHRM4FFAR4
SCHEMBL3006609 0.89 AVPR1B (0.40) LIPEAVPR1BEPHX2
SCHEMBL3013307 0.88 KDM4E (0.40) AVPR1BEPHX2TRPM8
SCHEMBL3017294 0.88 CSNK1D (0.36) LIPEAVPR1BEPHX2CHRM4FFAR4
SCHEMBL3011437 0.88 HTR2A (0.39) EPHX2HTR2A
SCHEMBL3014285 0.88 GBA1 (0.41)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 LIPE 2030/4885AVPR1B 4478/4885KIT 4404/4885

“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.