SCHEMBL25916762

SCHEMBL25916762

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

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
HSD17B10 Q99714 1/20 0.35
CXCR3 P49682 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
ACHE P22303 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
ITGB3 P05106 3/20 0.32
ITGA2B P08514 3/20 0.32
NAMPT P43490 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
AOC2 O75106 1/20 0.32

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
SCHEMBL25904111 0.82 CHRM2 (0.39) CHRM2CHRM1CHRM3CXCR3DRD2
SCHEMBL23559993 0.78 NCF1 (0.41) ACHEGNAI3GNAO1GNAI1
SCHEMBL16549320 0.76 PIK3CD (0.45) DRD2
SCHEMBL22856068 0.75 HRH3 (0.39) ACHE
SCHEMBL22837640 0.74 HRH3 (0.36) ACHE
SCHEMBL21107628 0.74 PIK3CD (0.35) ACHE
SCHEMBL24673628 0.74 ACHE (0.34) ACHE
SCHEMBL25904114 0.73 SIGMAR1 (0.37) CHRM2CHRM1CHRM3CXCR3ACHE
SCHEMBL18997472 0.73 GNAI3 (0.43) CXCR3DRD2DRD4DRD3GNAI3
SCHEMBL27270298 0.73 CXCR3 (0.37) CXCR3DRD2DRD4DRD3GNAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) 2023-07-27 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-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF IRAK4, IRAK2, IRAK1 CHRM2 4829/4885CHRM1 4841/4885CHRM3 4775/4885

“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.