SCHEMBL30948243

SCHEMBL30948243

O=C1C(=O)N(C2CCCC2)CCN1Cc1ccc(N2CCOCC2)nn1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 7/20 0.54
TP53 P04637 4/20 0.38
LMNA P02545 2/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
CASP1 P29466 3/20 0.36
CASP7 P55210 3/20 0.36
HSD17B10 Q99714 3/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC5A2 P31639 1/20 0.35

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
SCHEMBL30948107 0.91 IL4I1 (0.58) IL4I1TP53LMNA
SCHEMBL30047290 0.91 IL4I1 (0.58) IL4I1TP53LMNA
SCHEMBL27163486 0.91 IL4I1 (0.58) IL4I1TP53LMNA
SCHEMBL30948007 0.90 IL4I1 (0.57) IL4I1TP53LMNA
SCHEMBL30948355 0.84 IL4I1 (0.54) IL4I1TP53LMNA
SCHEMBL30948046 0.84 IL4I1 (0.58) IL4I1TP53LMNA
SCHEMBL27163560 0.81 IL4I1 (0.61) IL4I1TP53LMNA
SCHEMBL30948242 0.81 IL4I1 (0.53) IL4I1TP53LMNA
SCHEMBL27163551 0.80 IL4I1 (0.61) IL4I1TP53LMNAMAPT
SCHEMBL30047175 0.79 IL4I1 (0.60) IL4I1TP53LMNAMAPT

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-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-07-25 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-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL2 IL4I1 1/4885TP53 1444/4885LMNA 1870/4885

“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.