SCHEMBL3019380

SCHEMBL3019380

Cc1cccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(OC(F)(F)F)cc4)CC3)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.38
EPHX2 P34913 2/20 0.36
CHRM4 P08173 1/20 0.36
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
MDM2 Q00987 2/20 0.35
SCN9A Q15858 1/20 0.35
GBA1 P04062 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
AVPR1B P47901 1/20 0.35
DNM1L O00429 3/20 0.34
KIT P10721 1/20 0.34
HTR2A P28223 1/20 0.34
RORC P51449 1/20 0.34
HTR6 P50406 1/20 0.34
TRPM8 Q7Z2W7 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
SCHEMBL3016319 0.92 LIPE (0.40) LIPEEPHX2CHRM4BCHEACHE
SCHEMBL3017993 0.91 MAPT (0.41) EPHX2SCN9ARAB9A
SCHEMBL3014347 0.91 HDAC3 (0.35) LIPEEPHX2CHRM4SCN9ANPC1
SCHEMBL3016941 0.90 LIPE (0.44) LIPEEPHX2CHRM4BCHEACHE
SCHEMBL3018194 0.90 HTR2A (0.39) LIPEBCHEACHESCN9AGBA1
SCHEMBL3011689 0.89 LIPE (0.37) LIPEEPHX2CHRM4BCHEACHE
SCHEMBL2997684 0.89 GBA1 (0.43) GBA1NPC1RAB9ADNM1LHTR2A
SCHEMBL3014913 0.88 MAPT (0.40) GBA1NPC1RAB9ADNM1LHTR2A
SCHEMBL3006198 0.87 LIPE (0.38) LIPEEPHX2CHRM4SCN9AGBA1
SCHEMBL3000034 0.87 AVPR1B (0.42) LIPEEPHX2CHRM4BCHEACHE

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 2030/4885EPHX2 4409/4885CHRM4 4476/4885

“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.