SCHEMBL785944

SCHEMBL785944

Cc1cc(N2CCC(N(C)C(=O)c3ccc4c(c3)C(NC(=O)Nc3cccc(Cl)c3Cl)CC4)CC2)cc(C)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.41
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
F10 P00742 1/20 0.37
TSHR P16473 1/20 0.37
JAK2 O60674 3/20 0.37
JAK1 P23458 3/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
GHSR Q92847 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
SCHEMBL785814 0.94 TAS1R3 (0.44) TRPV1TAS1R3TAS1R1F10JAK2
SCHEMBL784725 0.92 F10 (0.40) TRPV1F10JAK2JAK1TLR9
SCHEMBL785270 0.89 F10 (0.42) TRPV1TAS1R3TAS1R1F10TLR9
SCHEMBL785702 0.89 F10 (0.42) TRPV1TAS1R3TAS1R1F10TLR9
SCHEMBL785213 0.88 WDR5 (0.41) TAS1R3TAS1R1F10TLR9TLR8
SCHEMBL784714 0.87 TRPV1 (0.42) TRPV1TAS1R3TAS1R1JAK2JAK1
SCHEMBL785369 0.87 F10 (0.38) F10TSHRJAK2JAK1TLR9
SCHEMBL784884 0.87 TRPV1 (0.41) TRPV1F10TSHRJAK2JAK1
SCHEMBL784092 0.86 CCNC (0.42) TRPV1F10TSHRJAK2JAK1
SCHEMBL785571 0.86 F10 (0.41) TRPV1F10JAK2JAK1TLR9

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 TRPV1 21/4885TAS1R3 202/4885TAS1R1 75/4885

“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.