SCHEMBL1774019

SCHEMBL1774019

CC(C)(C)OC(=O)N1CCN(c2nccc3sc(S(=O)(=O)Nc4cc(F)cc(C(F)(F)F)c4)cc23)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.40
STS P08842 1/20 0.39
KIT P10721 2/20 0.39
GRIA1 P42261 1/20 0.39
MAPT P10636 1/20 0.38
MMP13 P45452 1/20 0.36
MET P08581 1/20 0.35
TRPV1 Q8NER1 3/20 0.35
SYK P43405 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TRPA1 O75762 1/20 0.34
ACHE P22303 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
SCHEMBL1775697 0.83 MEN1 (0.48) TGFBR1STSKITMAPTMET
Hydrochloric Acid SCHEMBL1774117 0.82 HTR2C (0.39)
SCHEMBL1778714 0.80 ACHE (0.45) TGFBR1KITMMP13MEN1KMT2A
SCHEMBL1775701 0.79 TRPV1 (0.40) TGFBR1KITMAPTTRPV1MEN1
SCHEMBL1774709 0.78 TRPA1 (0.42) TGFBR1KITGRIA1METTRPV1
SCHEMBL1774067 0.77 TRPV1 (0.40) TGFBR1KITGRIA1MAPTTRPV1
SCHEMBL1775413 0.77 MALT1 (0.48) TGFBR1KIT
SCHEMBL1775437 0.76 ACHE (0.47) STSKITGRIA1MMP13MEN1
Hydrochloric Acid SCHEMBL6428008 0.75 KIT (0.38) TGFBR1KITGRIA1MAPTTRPV1
SCHEMBL1774986 0.75 GRIA1 (0.41) KITGRIA1MEN1KMT2AACHE

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
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
EP-1897881-A2 Compounds useful for the treatment of obesity, type II diabetes and CNS disorders Biovitrum AB (publ) (SE) 2008-03-12 EP disclosed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 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-20040024210-A1 New compounds SULT1E1, SULT2A1, SULT1A1 TGFBR1 4355/4885STS 4/4885KIT 4787/4885

“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.