SCHEMBL27201599

SCHEMBL27201599

O=C(O)N1CCCC(c2ncn3ccccc23)C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.43
JAK1 P23458 3/20 0.43
TYK2 P29597 3/20 0.43
JAK3 P52333 3/20 0.43
PROKR1 Q8TCW9 2/20 0.38
ALDH1A1 P00352 2/20 0.38
PDE2A O00408 2/20 0.37
PDE3A Q14432 1/20 0.37
HSD11B1 P28845 3/20 0.37
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
HIF1A Q16665 1/20 0.36
DRD4 P21917 1/20 0.36

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
SCHEMBL27201403 0.83 JAK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL3312540 0.72 ALDH1A1 (0.62) PROKR1ALDH1A1HSD11B1HPGDLMNA
SCHEMBL27201606 0.71 CHRM1 (0.41) JAK2JAK1JAK3
SCHEMBL27201362 0.71 HRH4 (0.42) LMNA
SCHEMBL6347014 0.70 HSD11B1 (0.53) PROKR1PDE2APDE3AHSD11B1DRD4
SCHEMBL27201472 0.70 HDAC4 (0.48) PDE2APDE3AHSD11B1
SCHEMBL28773886 0.68 DDB1 (0.45) PROKR1ALDH1A1PDE2APDE3AHSD11B1
SCHEMBL31215226 0.68 JAK2 (0.38) JAK2JAK1TYK2JAK3HSD11B1
SCHEMBL13490412 0.67 KDM5A (0.54) ALDH1A1HSD11B1HPGD
SCHEMBL27984145 0.66 MYC (0.47) PROKR1ALDH1A1HSD11B1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 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 (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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS GID4, MDM2, XIAP JAK2 1493/4885JAK1 2614/4885TYK2 3017/4885

“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.