SCHEMBL26173142

SCHEMBL26173142

CC(C)C(=O)N1CCN(C2CCN(C(C)C)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.48
CYP2D6 P10635 1/20 0.41
KCNH2 Q12809 1/20 0.41
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
CHRM1 P11229 2/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL25075229 0.93 HRH3 (0.45) HRH3CYP2D6KCNH2CHRM1CHRM2
SCHEMBL25107536 0.87 MEN1 (0.46) ACACBACACACHRM1CHRM2CYP3A4
SCHEMBL15504825 0.87 MTNR1A (0.43) HRH3KCNH2ACACBACACAMTNR1A
SCHEMBL26295567 0.84 CHRNB2 (0.42) HRH3CYP2D6KCNH2MTNR1AMTNR1B
SCHEMBL19203866 0.84 HRH3 (0.49) HRH3CYP2D6KCNH2
SCHEMBL4475509 0.84 HRH3 (0.49) HRH3CYP2D6KCNH2CYP2C19
SCHEMBL13417645 0.84 POLB (0.50) HRH3KCNH2CHRM1
SCHEMBL4546623 0.84 POLB (0.46) HRH3KCNH2CHRM1
SCHEMBL23384264 0.83 HRH3 (0.48) HRH3CYP2D6KCNH2
SCHEMBL10051736 0.82 POLB (0.53) HRH3KCNH2

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
WO-2023098656-A1 COMPOUNDS FOR THE DEGRADATION OF EGFR KINASE BEIGENE, LTD. (GB) 2023-06-08 WO disclosed
US-20230137175-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. 2023-05-04 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-20230137175-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE BTK, BCL9, CRBN HRH3 3222/4885CYP2D6 3924/4885KCNH2 4681/4885

“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.