SCHEMBL21993836

SCHEMBL21993836

CCN1CCOC(CC(C)N2CCN(C(C)C)CC2)C1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.37
DRD3 P35462 1/20 0.33
CCR2 P41597 1/20 0.32
KCNH2 Q12809 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
SCHEMBL23920781 0.87 HRH3 (0.43) HRH3DRD3CCR2KCNH2
SCHEMBL21745492 0.82 HRH3 (0.36) HRH3
SCHEMBL4550368 0.80 HRH3 (0.42) HRH3DRD3CCR2KCNH2
SCHEMBL21157892 0.77 HRH3 (0.45) HRH3DRD3CCR2KCNH2
SCHEMBL22893242 0.76 HRH3 (0.47) HRH3DRD3CCR2KCNH2
SCHEMBL24700866 0.76 HRH3 (0.47) HRH3DRD3CCR2KCNH2
SCHEMBL26194411 0.75 HRH3 (0.46) HRH3DRD3CCR2KCNH2
SCHEMBL24256708 0.73 HRH3 (0.44) HRH3DRD3CCR2KCNH2
SCHEMBL25872792 0.73 HRH3 (0.44) HRH3DRD3CCR2KCNH2
SCHEMBL9801701 0.73 HRH3 (0.46) HRH3DRD3CCR2KCNH2

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-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-09-28 US disclosed
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2020-05-14 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-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein MCL1, BCL2A1, BCL2L1 HRH3 4814/4885DRD3 4686/4885CCR2 2115/4885
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 HRH3 4814/4885DRD3 4686/4885CCR2 2115/4885

“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.