SCHEMBL803705

SCHEMBL803705

CN(C(=O)C(F)(F)F)C1CCN(c2ccc3cnccc3c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.43
PRMT3 O60678 1/20 0.42
TRPV1 Q8NER1 2/20 0.41
PHGDH O43175 1/20 0.40
CCKAR P32238 1/20 0.40
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
NPY5R Q15761 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP46A1 Q9Y6A2 1/20 0.38
F2 P00734 1/20 0.38
PLAT P00750 1/20 0.38
KLKB1 P03952 1/20 0.38
SYK P43405 1/20 0.38
ABL1 P00519 1/20 0.38
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37

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
SCHEMBL803945 0.83 PDE10A (0.44) F10PRMT3PHGDHCCKARNPY5R
SCHEMBL10274785 0.81 PHGDH (0.45) PHGDH
SCHEMBL4171144 0.77 NPY5R (0.56) NPY5RCYP3A4
SCHEMBL7299663 0.75 NPY5R (0.46) NPY5R
SCHEMBL784978 0.74 ACHE (0.41) F10PRMT3
SCHEMBL803946 0.72 KDM4E (0.51) PHGDHMMP2MMP13ADAMTS5
SCHEMBL7293116 0.71 MAPT (0.54)
SCHEMBL785076 0.71 F10 (0.39) F10PRMT3PHGDHNPY5RF2
SCHEMBL784656 0.71 ABL1 (0.40) F10PRMT3NPY5RABL1
SCHEMBL15516206 0.70 CYP19A1 (0.54) PRMT3PHGDHMMP2MMP13ADAMTS5

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 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

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 524/4885PRMT3 2202/4885TRPV1 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.