SCHEMBL784134

SCHEMBL784134

CN(C(=O)c1ccc2c(c1)C(NS(=O)(=O)c1c(Cl)cccc1C(F)(F)F)CCC2)C1CCN(c2ccncc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.37
RORC P51449 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
SLC2A1 P11166 2/20 0.34
CTSS P25774 1/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
PDK2 Q15119 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.33
CHRM1 P11229 1/20 0.33
NPY5R Q15761 1/20 0.33

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
SCHEMBL785149 0.96 F10 (0.38) F10RORCPDK2CHRM1NPY5R
SCHEMBL785212 0.91 F10 (0.39) F10RORCSLC2A1PDK2NPY5R
SCHEMBL784883 0.88 F10 (0.37) F10RORCSLC2A1PDK2NPY5R
SCHEMBL774799 0.87 F10 (0.39) F10RORCNPY5R
SCHEMBL785707 0.87 F10 (0.39) F10RORCNPY5R
SCHEMBL784793 0.86 TAS1R3 (0.45) F10RORCTRPV1SLC2A1CTSS
SCHEMBL785596 0.84 RORC (0.37) F10RORCSLC2A1CTSSPDK2
SCHEMBL784902 0.83 CTSS (0.41) TRPV1SLC2A1CTSSLMNAPOLB
SCHEMBL784219 0.82 F10 (0.41) F10CHRM1NPY5R
SCHEMBL783708 0.81 RORC (0.42) F10RORCCTSS

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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US claimed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US claimed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 F10 524/4885RORC 4667/4885TRPV1 21/4885

“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.