SCHEMBL21472222

SCHEMBL21472222

CCN[C@H]1C[C@H](OC2CCN(CC(C)C)CC2)C1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.38
NAMPT P43490 1/20 0.32
PIK3CD O00329 2/20 0.31
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2D6 P10635 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
SCHEMBL21026170 0.84 HRH3 (0.40) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL25888121 0.83 HRH3 (0.39) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL20129353 0.83 HRH3 (0.39) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL23560035 0.82 HRH3 (0.49) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL23945274 0.81 HRH3 (0.36) HRH3
SCHEMBL18592313 0.81 HRH3 (0.37) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL20443206 0.81 HRH3 (0.37) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL25916228 0.81 HRH3 (0.40) HRH3NAMPTPIK3CDROCK2ROCK1
SCHEMBL24673647 0.80 ROCK2 (0.39) HRH3PIK3CDROCK2ROCK1CYP2D6
SCHEMBL24607658 0.80 HRH3 (0.40) HRH3NAMPTPIK3CDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL HRH3 4061/4885NAMPT 4424/4885PIK3CD 2656/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL HRH3 4061/4885NAMPT 4424/4885PIK3CD 2656/4885

“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.