SCHEMBL21998018

SCHEMBL21998018

CC1CC(C(=O)O)CCC1n1cc(N)c(N2CCOCC2)n1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 1/20 0.35
CYP2C19 P33261 1/20 0.32
LGMN Q99538 1/20 0.31
KDM4E B2RXH2 4/20 0.31
GBA1 P04062 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PIK3R1 P27986 7/20 0.31
PIK3CA P42336 7/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
STAT3 P40763 1/20 0.31
TSHR P16473 1/20 0.30
GAA P10253 1/20 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
SCHEMBL21997644 0.77
SCHEMBL21069513 0.77 JAK1 (0.32)
SCHEMBL21998056 0.75 ELANE (0.34)
SCHEMBL23807030 0.73 LGMN (0.39) NEK2LGMNKDM4EALDH1A1MAPT
SCHEMBL21997089 0.73 LGMN (0.39) NEK2LGMNKDM4EALDH1A1MAPT
SCHEMBL22835704 0.69 IRAK4 (0.32)
SCHEMBL22835293 0.69 LGMN (0.36) LGMNKDM4EGBA1ALDH1A1MAPT
SCHEMBL21997745 0.66 LRRK2 (0.35) KDM4EPIK3R1PIK3CATSHRGAA
SCHEMBL23807685 0.66 LRRK2 (0.35) KDM4EPIK3R1PIK3CATSHRGAA
SCHEMBL21997848 0.66 CYP1A2 (0.40) CYP2C19KDM4EALDH1A1MAPK1MAPT

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 NEK2 660/4885CYP2C19 3990/4885LGMN 1200/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 NEK2 660/4885CYP2C19 3990/4885LGMN 1200/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 NEK2 660/4885CYP2C19 3990/4885LGMN 1200/4885
US-20240239777-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 NEK2 660/4885CYP2C19 3990/4885LGMN 1200/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 NEK2 660/4885CYP2C19 3990/4885LGMN 1200/4885

“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.