SCHEMBL19652123

SCHEMBL19652123

CN(CCC1CCN(C2CC2)CC1)C(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.41
BCHE P06276 1/20 0.35
CHRM4 P08173 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL19652281 0.94 ACHE (0.39) ACHEBCHEMEN1KMT2A
SCHEMBL19658648 0.85 ACHE (0.55) ACHEBCHECHRM4
SCHEMBL19652098 0.85 ACHE (0.42) ACHECHRM4ALDH1A1
SCHEMBL19652132 0.85 BCHE (0.36) ACHEBCHEMEN1KMT2AALDH1A1
SCHEMBL19652115 0.83 ACHE (0.46) ACHE
SCHEMBL19652095 0.81 ACHE (0.39) ACHE
SCHEMBL19658464 0.79 ACHE (0.52) ACHEBCHEMEN1KMT2A
SCHEMBL19652102 0.79 SIGMAR1 (0.36) BCHEMEN1KMT2A
SCHEMBL19658462 0.71 ACHE (0.38) ACHEBCHECHRM4ALDH1A1
SCHEMBL27417087 0.71 CYP1A2 (0.45) MEN1KMT2A

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-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 ACHE 2649/4885BCHE 1184/4885CHRM4 2474/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 ACHE 2649/4885BCHE 1184/4885CHRM4 2474/4885

“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.