SCHEMBL784276

SCHEMBL784276

CN(C(=O)c1ccc2c(c1)C(NC(=O)c1cc(F)ccc1Cl)CC2(C)C)C1CCN(c2ccncc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.39
NPY5R Q15761 3/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
BDKRB1 P46663 1/20 0.34
CRHR1 P34998 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
SCHEMBL785855 0.92 JAK2 (0.40) CRHR1
SCHEMBL785090 0.91 BDKRB1 (0.40) F10ALDH1A1ALOX15BDKRB1
SCHEMBL785712 0.88 F10 (0.37) F10NPY5RALDH1A1ALOX15BDKRB1
SCHEMBL784904 0.88 F10 (0.40) F10NPY5RBDKRB1
SCHEMBL784390 0.86 CTSS (0.42) F10ALDH1A1
SCHEMBL785504 0.85 F10 (0.37) F10NPY5RALDH1A1ALOX15
SCHEMBL784439 0.85 SLC6A9 (0.40) F10
SCHEMBL784626 0.85 RBP4 (0.36) F10NPY5RALDH1A1ALOX15
SCHEMBL785791 0.85 ALDH1A1 (0.41) F10NPY5RALDH1A1ALOX15
SCHEMBL784112 0.85 F10 (0.40) F10NPY5R

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 4 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-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 524/4885NPY5R 54/4885ALDH1A1 1267/4885

“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.