SCHEMBL21997753

SCHEMBL21997753

CC1(O)CCN(c2ccn3nc(C(=O)O)cc3n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.44
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
HSD11B1 P28845 2/20 0.38
SYK P43405 3/20 0.37
KIF18A Q8NI77 1/20 0.33
ADORA2A P29274 1/20 0.32
PRMT5 O14744 1/20 0.32
PTPN11 Q06124 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
OPRD1 P41143 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
PDE10A Q9Y233 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
SCHEMBL25338105 0.84 APOBEC3A (0.47) APOBEC3AAPOBEC3GHSD11B1SYKALDH1A1
SCHEMBL25339261 0.84 APOBEC3A (0.47) APOBEC3AAPOBEC3GSYKALDH1A1KDM4E
SCHEMBL21997075 0.84 APOBEC3A (0.43) APOBEC3AAPOBEC3GHRH3ALDH1A1KDM4E
SCHEMBL25339582 0.84 APOBEC3A (0.43) PTGER4APOBEC3AAPOBEC3GSYKALDH1A1
SCHEMBL25339426 0.83 APOBEC3A (0.39) PTGER4APOBEC3AAPOBEC3GSYKKIF18A
SCHEMBL21996782 0.83 APOBEC3A (0.46) APOBEC3AAPOBEC3GHSD11B1SYKALDH1A1
SCHEMBL21996998 0.81 KMO (0.50) APOBEC3AAPOBEC3GALDH1A1KDM4E
SCHEMBL25341150 0.80 KDM4E (0.43) APOBEC3AAPOBEC3GALDH1A1KDM4E
SCHEMBL21997705 0.80 SMPD3 (0.47) PTGER4APOBEC3AAPOBEC3GHSD11B1ADORA2A
SCHEMBL25337091 0.79 APOBEC3A (0.38) APOBEC3AAPOBEC3GSYKKIF18AALDH1A1

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 8 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
EP-4100004-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2022-12-14 EP 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-2021158634-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-08-12 WO 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 (4 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 PTGER4 3404/4885APOBEC3A 219/4885APOBEC3G 151/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 PTGER4 3404/4885APOBEC3A 219/4885APOBEC3G 151/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PTGER4 3404/4885APOBEC3A 219/4885APOBEC3G 151/4885
US-20240239777-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PTGER4 3404/4885APOBEC3A 219/4885APOBEC3G 151/4885

“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.