SCHEMBL23728481

SCHEMBL23728481

COC(=O)c1cnn2c(C(C)C)ccnc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 6/20 0.48
PIM1 P11309 3/20 0.44
LIMK1 P53667 2/20 0.44
BRAF P15056 1/20 0.42
HSD17B10 Q99714 4/20 0.42
HPGD P15428 3/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAP2K1 Q02750 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
LMNA P02545 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
MAPK13 O15264 3/20 0.41
MARK2 Q7KZI7 1/20 0.41
CASP1 P29466 2/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL23728533 0.87 KDM4E (0.54) KDM4EALDH1A1PIM1LIMK1MAP2K1
SCHEMBL25162482 0.86 KDM4E (0.44) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL23728502 0.78 KDM4E (0.45) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL23728564 0.78 HSD11B1 (0.52) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL23728439 0.77 KDM4E (0.59) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL30184310 0.73 MAPK13 (0.44) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL23132773 0.72 KDM4E (0.53) KDM4EALDH1A1PIM1HPGDKMT2A
SCHEMBL12913573 0.72 GPR119 (0.37) KDM4EALDH1A1HPGDMAP2K1CLK4
SCHEMBL30931731 0.72 KDM4E (0.60) KDM4EALDH1A1PIM1LIMK1BRAF
SCHEMBL23728419 0.71 GPR119 (0.36) KDM4EALDH1A1HPGDMAP2K1CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230122219-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-20 US disclosed
US-20230122219-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-20 US disclosed
EP-4100004-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2022-12-14 EP disclosed
WO-2021158634-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-08-12 WO disclosed
WO-2021158634-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-08-12 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 (1 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-20230122219-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 KDM4E 190/4885ALDH1A1 2776/4885PIM1 274/4885

“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.