SCHEMBL784493

SCHEMBL784493

CCN(C(=O)c1ccc2c(c1)C(NC(=O)c1sccc1Cl)CC2)C1CCN(c2ccncc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.37
CTSS P25774 1/20 0.37
AURKA O14965 1/20 0.35
F10 P00742 9/20 0.35
HTR1A P08908 1/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
KCNH2 Q12809 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
OPRM1 P35372 3/20 0.34
OPRD1 P41143 2/20 0.34
OPRK1 P41145 2/20 0.34
CCR5 P51681 1/20 0.33
WDR5 P61964 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
SCHEMBL785753 0.90 F10 (0.38) RIPK1CTSSAURKAF10HTR1A
SCHEMBL784268 0.87 TAS1R3 (0.42) RIPK1CTSSTAS1R3TAS1R1CCR5
SCHEMBL785314 0.85 CTSS (0.44) CTSSAURKAF10TAS1R3TAS1R1
SCHEMBL784684 0.85 CTSS (0.39) RIPK1CTSSF10HTR1ADRD2
SCHEMBL785127 0.84 F10 (0.38) RIPK1AURKAF10TAS1R3TAS1R1
SCHEMBL784492 0.82 BDKRB1 (0.45) F10
SCHEMBL784303 0.81 WDR5 (0.39) RIPK1CTSSAURKAF10HTR1A
SCHEMBL784152 0.81 CTSS (0.38) CTSSAURKAF10HTR1ADRD2
SCHEMBL784852 0.80 F10 (0.38) CTSSAURKAF10TAS1R3TAS1R1
SCHEMBL484436 0.80 CYP3A4 (0.48) RIPK1

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 RIPK1 4084/4885CTSS 824/4885AURKA 3163/4885

“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.