SCHEMBL24257541

SCHEMBL24257541

Cc1c(-c2cnn(C3CCOCC3)c2)cnc(C#N)c1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 3/20 0.44
MAP4K3 Q8IVH8 1/20 0.41
ALK Q9UM73 3/20 0.40
KCNJ5 P48544 1/20 0.40
EML4 Q9HC35 1/20 0.39
USP1 O94782 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
LRRK2 Q5S007 3/20 0.38
MET P08581 2/20 0.38
TBK1 Q9UHD2 1/20 0.38
GRK5 P34947 1/20 0.37
RET P07949 1/20 0.37

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
SCHEMBL24257689 0.84 IRAK4 (0.44) IRAK4MAP4K3ALKUSP1MKNK1
Nitrous Acid SCHEMBL29248905 0.82 IRAK4 (0.42) IRAK4MAP4K3ALKUSP1MKNK1
SCHEMBL30453163 0.82 TNK2 (0.47) METRET
SCHEMBL24257799 0.82 TNK2 (0.47) METRET
Glycine SCHEMBL29248906 0.81 IRAK4 (0.41) IRAK4MAP4K3ALKUSP1LRRK2
SCHEMBL29248903 0.80 IRAK4 (0.41) IRAK4MAP4K3ALKUSP1MKNK1
SCHEMBL24257678 0.79 GRM4 (0.50) KDM4EALDH1A1TSHR
SCHEMBL24257581 0.79 RET (0.38) KDM4EALDH1A1HPGDTSHRHSD17B10
Glycine SCHEMBL30546830 0.78 IRAK4 (0.39) IRAK4MAP4K3ALKUSP1KDM4E
SCHEMBL24257737 0.78 IRAK4 (0.47) IRAK4ALKKCNJ5EML4MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295110-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE AKEBIA THERAPEUTICS, INC. (US) 2023-09-21 US disclosed
US-20230295110-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE AKEBIA THERAPEUTICS, INC. (US) 2023-09-21 US disclosed
EP-4196466-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE Akebia Therapeutics Inc. (US) 2023-06-21 EP disclosed
WO-2022036188-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE AKEBIA THERAPEUTICS, INC. (US) 2022-02-17 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-20230295110-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE HIF1AN, EGLN3, PHF20 IRAK4 133/4885MAP4K3 575/4885ALK 3906/4885

“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.