SCHEMBL21107366

SCHEMBL21107366

C#CCN1CCO[C@@H](CCN(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 8/20 0.35
▸ DRD2 P14416 2/20 0.32
▸ DRD3 P35462 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ BCHE P06276 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
SCHEMBL21106590 1.00 DRD4 (0.35) DRD4DRD2DRD3CYP1A2CYP3A4
SCHEMBL21070445 0.84 BCHE (0.40) DRD4DRD2DRD3CYP1A2CYP3A4
SCHEMBL21070814 0.84 BCHE (0.40) DRD4DRD2DRD3CYP1A2CYP3A4
SCHEMBL25997678 0.79 BCHE (0.31) BCHE
SCHEMBL23518729 0.76 EPHX1 (0.35) DRD4DRD2DRD3BCHE
SCHEMBL21069557 0.76 PDK1 (0.45) DRD4DRD2DRD3
SCHEMBL26925497 0.74 BCHE (0.41) BCHE
SCHEMBL26923812 0.74 BCHE (0.41) BCHE
SCHEMBL18772752 0.74 HRH3 (0.36) DRD4
SCHEMBL21069599 0.73 DRD2 (0.33) DRD4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807636-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-11-07 — — US disclosed
US-11352350-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-06-07 — — US disclosed
US-11318205-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-05-03 — — US disclosed
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-10-21 — — US disclosed
US-11117889-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2021-09-14 — — US disclosed
US-10874743-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2020-12-29 — — US disclosed
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2019-06-27 — — 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 (7 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-10874743-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-11117889-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885
US-11318205-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 DRD4 4363/4885DRD2 4346/4885DRD3 4304/4885

“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.

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