SCHEMBL23536287

SCHEMBL23536287

Cn1c(=O)n(C2C(=O)CCNC2=O)c2cccc(N3CCNCC3)c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 4/20 0.36
HTR6 P50406 5/20 0.35
DRD2 P14416 3/20 0.35
DRD3 P35462 3/20 0.35
HTR3E A5X5Y0 2/20 0.35
HTR3B O95264 2/20 0.35
HTR3A P46098 2/20 0.35
HTR3D Q70Z44 2/20 0.35
HTR3C Q8WXA8 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
CYP2C19 P33261 1/20 0.35
HTR2A P28223 3/20 0.35
HTR1A P08908 2/20 0.35
HTR2C P28335 2/20 0.35
DRD4 P21917 1/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
BRPF1 P55201 1/20 0.34
DPP4 P27487 1/20 0.34
HTR7 P34969 2/20 0.34

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
SCHEMBL23536575 0.90 DRD2 (0.42) HTR6DRD2CYP2C19MAPTDPP4
SCHEMBL25340885 0.88 DDB1 (0.31) MAPTBRPF1
SCHEMBL23536286 0.88 DRD2 (0.33) DRD2
SCHEMBL23728512 0.87 DDB1 (0.32) DRD2DRD3
SCHEMBL25339763 0.85
SCHEMBL27224961 0.84 ENPP1 (0.33) DRD2DRD3DRD4MAPT
SCHEMBL22835167 0.82 DDB1 (0.33)
SCHEMBL25340231 0.80
SCHEMBL27033139 0.80 SIGMAR1 (0.36) SIGMAR1HTR1AMAPTMTOR
SCHEMBL26635023 0.79 DDB1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 US disclosed
US-11591332-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-02-28 US disclosed
US-20220340570-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-27 US disclosed
WO-2021127283-A2 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-06-24 WO 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 (3 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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ADRB1 4186/4885HTR6 3032/4885DRD2 4346/4885
US-11591332-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ADRB1 4186/4885HTR6 3032/4885DRD2 4346/4885
US-20220340570-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ADRB1 4186/4885HTR6 3032/4885DRD2 4346/4885

“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.