SCHEMBL21997761

SCHEMBL21997761

CC(C)(C)C1(COC2CCNCC2)CCN(C(=O)O)CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 2/20 0.34
TPSD1 Q9BZJ3 2/20 0.34
TPSG1 Q9NRR2 2/20 0.34
KDM1A O60341 4/20 0.34
ITGB3 P05106 5/20 0.32
ITGA2B P08514 5/20 0.32
MAOA P21397 3/20 0.30

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
SCHEMBL29132137 0.69 ITGB3 (0.32) ITGB3ITGA2B
SCHEMBL27137149 0.69 ITGB3 (0.50) TPSAB1TPSD1TPSG1ITGB3ITGA2B
SCHEMBL19022998 0.68 CHRM4 (0.37) ITGB3ITGA2B
SCHEMBL22633470 0.68
SCHEMBL23035036 0.67 TP53 (0.34)
SCHEMBL14952431 0.67 CYP4A11 (0.34) ITGB3ITGA2B
SCHEMBL29277070 0.67 ITGB3 (0.41) TPSAB1TPSD1TPSG1KDM1AITGB3
SCHEMBL4712402 0.67 GABRA1 (0.39) TPSAB1TPSD1TPSG1ITGB3ITGA2B
SCHEMBL30889781 0.67 KDM1A (0.32) KDM1AITGB3ITGA2B
Hydrochloric Acid SCHEMBL19210387 0.67 NAMPT (0.34) ITGB3ITGA2B

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-20240239777-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-07-18 US disclosed
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-20210323952-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-10-21 US disclosed
EP-3886904-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2021-10-06 EP disclosed
US-11117889-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2021-09-14 US disclosed
WO-2020113233-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-06-04 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 (5 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-11117889-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 TPSAB1 1844/4885TPSD1 2555/4885TPSG1 2439/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 TPSAB1 1844/4885TPSD1 2555/4885TPSG1 2439/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 TPSAB1 1844/4885TPSD1 2555/4885TPSG1 2439/4885
US-20240239777-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 TPSAB1 1844/4885TPSD1 2555/4885TPSG1 2439/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 TPSAB1 1844/4885TPSD1 2555/4885TPSG1 2439/4885

“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.