SCHEMBL22902609

SCHEMBL22902609

CC(C)(O)c1cn2c(n1)c(C(N)=O)cc1cccc(O)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.38
PARP1 P09874 9/20 0.35
KDM4E B2RXH2 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TYK2 P29597 1/20 0.33
PARP2 Q9UGN5 3/20 0.33
PARP3 Q9Y6F1 3/20 0.33
IKBKB O14920 1/20 0.33
PIM1 P11309 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PKMYT1 Q99640 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32
GAA P10253 1/20 0.31
RCE1 Q9Y256 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
SCHEMBL29790088 0.85 ADORA2A (0.42) PARP1KDM4ETYK2ALDH1A1HPGD
SCHEMBL22902460 0.85 ADORA2A (0.42) PARP1KDM4ETYK2ALDH1A1HPGD
SCHEMBL22902568 0.83 PARP1 (0.41) LCKPARP1KDM4EL3MBTL1PARP2
SCHEMBL29790096 0.81 IKBKB (0.38) PARP1KDM4ETYK2PARP2PARP3
SCHEMBL22902515 0.75 LCK (0.43) LCKPARP1KDM4EL3MBTL1PARP2
SCHEMBL22902704 0.74 KDM4E (0.43) LCKPARP1KDM4EL3MBTL1IKBKB
SCHEMBL22902451 0.70 PARP1 (0.41) LCKPARP1KDM4EL3MBTL1PARP2
SCHEMBL22902790 0.69 LCK (0.42) LCKPARP1KDM4EL3MBTL1IKBKB
SCHEMBL22902757 0.69 LCK (0.42) LCKPARP1KDM4EL3MBTL1IKBKB
SCHEMBL22902800 0.68 ADORA2A (0.45) PARP1KDM4ETYK2ALDH1A1MAPT

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-12286428-B2 Tricyclic heteroaryl compounds useful as IRAK4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-29 US disclosed
EP-3999508-B1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-30 EP disclosed
EP-3999508-B1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-30 EP disclosed
US-20220259205-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2022-08-18 US disclosed
EP-3999508-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS Bristol-Myers Squibb Company (US) 2022-05-25 EP disclosed
WO-2021011724-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-01-21 WO disclosed
US-20160336519-A1 Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-11-17 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 (2 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-20220259205-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS IRAK4, IRAK1, IRAK3 LCK 174/4885PARP1 126/4885KDM4E 158/4885
US-12286428-B2 Tricyclic heteroaryl compounds useful as IRAK4 inhibitors IRAK4, IRAK1, IRAK3 LCK 174/4885PARP1 126/4885KDM4E 158/4885

“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.