SCHEMBL784867

SCHEMBL784867

CN(C(=O)c1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1ccccc1Cl)C1CCN(c2ccncc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.41
CHRM1 P11229 2/20 0.37
CCR5 P51681 1/20 0.36
NPY5R Q15761 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
CNR2 P34972 1/20 0.35
LSS P48449 1/20 0.35
GRIA2 P42262 1/20 0.35
ROCK2 O75116 1/20 0.35
HTR6 P50406 1/20 0.35

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
SCHEMBL784219 0.94 F10 (0.41) F10CHRM1CCR5NPY5RHTR2A
SCHEMBL785212 0.87 F10 (0.39) F10NPY5RGRIA2
SCHEMBL28802446 0.85 F10 (0.38) F10CCR5NPY5RLSSROCK2
SCHEMBL785404 0.84 TAS1R3 (0.44) F10
SCHEMBL785698 0.84 TAS1R3 (0.44) F10
SCHEMBL785455 0.83 F10 (0.37) F10CCR5NPY5RROCK2
SCHEMBL785594 0.83 F10 (0.38) F10CCR5NPY5RROCK2
SCHEMBL784029 0.82 F10 (0.41) F10CCR5NPY5RLSS
SCHEMBL785149 0.82 F10 (0.38) F10CHRM1NPY5R
SCHEMBL785681 0.82 TAS1R3 (0.42) F10ROCK2

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 8 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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
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 524/4885CHRM1 117/4885CCR5 460/4885

“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.