SCHEMBL23728561

SCHEMBL23728561

CN(C)c1cnc2c(C(=O)O)cnn2c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.42
TDP1 Q9NUW8 1/20 0.42
PDE2A O00408 5/20 0.40
HPGD P15428 2/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EPHB3 P54753 1/20 0.36
HSD11B1 P28845 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34

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
SCHEMBL23728532 0.82 ALDH1A1 (0.55) KDM4EALDH1A1HPGDPOLBMEN1
SCHEMBL310126 0.78 PDE2A (0.59) KDM4EALDH1A1TDP1PDE2AHSD11B1
SCHEMBL12505413 0.76 IRAK4 (0.43) KDM4EALDH1A1TDP1PDE2APOLB
SCHEMBL19030475 0.75 PDE2A (0.53) KDM4EALDH1A1PDE2AMEN1KMT2A
SCHEMBL28667748 0.75 KDM4E (0.41) KDM4EALDH1A1TDP1PDE2APOLB
SCHEMBL309283 0.75 KDM4E (0.43) KDM4EALDH1A1TDP1PDE2AIRAK4
SCHEMBL310187 0.75 KDM4E (0.43) KDM4EALDH1A1TDP1PDE2AHPGD
SCHEMBL310362 0.75 HSD11B1 (0.49) KDM4EALDH1A1TDP1PDE2AHSD17B10
SCHEMBL359148 0.74 HSD11B1 (0.52) KDM4EALDH1A1TDP1PDE2AHSD11B1
SCHEMBL23728540 0.74 PDE2A (0.43) KDM4EALDH1A1TDP1PDE2AHPGD

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
EP-4698517-A1 <SUP2/>? <SUB2/>?4?NOVEL COMPOUNDS AS ?? <NS1:SUB>7</NS1:SUB>?INHIBITORS Evotec International GmbH (DE) 2026-02-25 EP disclosed
WO-2024218058-A1 NOVEL COMPOUNDS AS α4β7 INHIBITORS EVOTEC INTERNATIONAL GMBH (DE) 2024-10-24 WO disclosed
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 2776/4885TDP1 236/4885

“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.