SCHEMBL16448704

SCHEMBL16448704

N#CC1(CO)C2CC3CC(C2)CC1C3

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.60
SCN9A Q15858 6/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DPP4 P27487 1/20 0.31

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
SCHEMBL13216478 0.75 HSD11B1 (1.00) HSD11B1ALDH1A1DPP4
SCHEMBL10844499 0.69 HSD11B1 (0.45) HSD11B1ALDH1A1SMN1; SMN2DPP4
SCHEMBL14953127 0.67 HSD11B1 (0.37) HSD11B1ALDH1A1SMN1; SMN2
SCHEMBL22811898 0.67 HSD11B1 (0.51) HSD11B1SCN9AALDH1A1SMN1; SMN2
SCHEMBL5679506 0.65 HSD11B1 (0.42) HSD11B1
SCHEMBL17008352 0.65 ALDH1A1 (0.44) HSD11B1ALDH1A1SMN1; SMN2
SCHEMBL5353785 0.64 HSD11B1 (0.41) HSD11B1ALDH1A1SMN1; SMN2
SCHEMBL3697996 0.64 HSD11B1 (0.32) HSD11B1ALDH1A1SMN1; SMN2
SCHEMBL16448628 0.64 HSD11B1 (0.36) HSD11B1ALDH1A1SMN1; SMN2
SCHEMBL21075546 0.64 HSD11B1 (0.41) HSD11B1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170002017-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-05 US disclosed
EP-2855428-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN Genentech, Inc. (US) 2015-04-08 EP disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
US-20130317001-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2013-11-28 US disclosed
WO-2013177224-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN GENENTECH, INC. (US) 2013-11-28 WO 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 (2 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-20170002017-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SNRPD2 HSD11B1 2602/4885SCN9A 1210/4885ALDH1A1 2216/4885
US-20130317001-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SNRPD2 HSD11B1 2602/4885SCN9A 1210/4885ALDH1A1 2216/4885

“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.