SCHEMBL20073196

SCHEMBL20073196

CN[C@H]1CCCC[C@@H]1N(C)CCF

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.31
SCN9A Q15858 1/20 0.30
LATS1 O95835 1/20 0.30

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
SCHEMBL20063425 0.89 SCN9A (0.37) SLC18A3SCN9A
SCHEMBL23374749 0.83 ADH1A (0.32) SLC18A3LATS1
SCHEMBL26620830 0.83 ADH1A (0.32) SLC18A3LATS1
SCHEMBL20063365 0.82
SCHEMBL20072863 0.82 IKZF1 (0.32)
SCHEMBL11456997 0.81 SCN9A (0.35) SLC18A3SCN9ALATS1
SCHEMBL20063405 0.79 SLC18A3 (0.38) SLC18A3SCN9A
SCHEMBL23423651 0.79 SCN9A (0.32) SCN9ALATS1
SCHEMBL26620827 0.79 SCN9A (0.32) SCN9ALATS1
SCHEMBL20063463 0.77 SCN9A (0.38) SCN9A

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-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 US disclosed
WO-2018072602-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-26 WO disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 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 (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-10457654-B2 Therapeutic compounds and methods of use thereof NPY5R, REN, F12 SLC18A3 2528/4885SCN9A 1478/4885LATS1 3871/4885
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 SLC18A3 2402/4885SCN9A 1501/4885LATS1 3785/4885

“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.