SCHEMBL30948266

SCHEMBL30948266

O=C1C(=O)N(C2CCCC2)CCN1Cc1ccc(-c2cccc(F)c2)nn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 8/20 1.00
TP53 P04637 4/20 0.41
PDE4A P27815 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
LMNA P02545 2/20 0.38
PER2 O15055 2/20 0.36
KCNH2 Q12809 1/20 0.36
GRM2 Q14416 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
SCHEMBL30947977 0.98 IL4I1 (0.96) IL4I1TP53PDE4ARXFP1LMNA
SCHEMBL30947900 0.89 IL4I1 (0.79) IL4I1TP53RXFP1LMNAPER2
SCHEMBL30046889 0.87 IL4I1 (0.77) IL4I1TP53RXFP1LMNA
SCHEMBL27162916 0.87 IL4I1 (0.77) IL4I1TP53RXFP1LMNA
SCHEMBL30948314 0.85 IL4I1 (0.74) IL4I1TP53RXFP1LMNA
SCHEMBL30948203 0.83 IL4I1 (0.71) IL4I1TP53KCNH2
SCHEMBL30948288 0.82 IL4I1 (0.96) IL4I1TP53RXFP1LMNAKCNH2
SCHEMBL30948229 0.81 IL4I1 (0.79) IL4I1TP53PDE4ARXFP1KCNH2
SCHEMBL30948012 0.80 IL4I1 (0.84) IL4I1TP53RXFP1LMNA
SCHEMBL30046257 0.80 IL4I1 (1.00) IL4I1TP53RXFP1LMNAKCNH2

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 1444/4885PDE4A 960/4885

“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.