SCHEMBL30948314

SCHEMBL30948314

O=C1C(=O)N(C2CCC2)CCN1Cc1ccc(-c2ccccc2)nn1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 8/20 0.74
RXFP1 Q9HBX9 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
POLB P06746 1/20 0.40
TP53 P04637 2/20 0.40
LMNA P02545 1/20 0.37
ACHE P22303 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
SCHEMBL27162916 0.98 IL4I1 (0.77) IL4I1RXFP1CYP11B1CYP11B2POLB
SCHEMBL30046889 0.98 IL4I1 (0.77) IL4I1RXFP1CYP11B1CYP11B2POLB
SCHEMBL30948361 0.87 IL4I1 (0.66) IL4I1RXFP1CYP11B1CYP11B2POLB
SCHEMBL30947977 0.87 IL4I1 (0.96) IL4I1RXFP1TP53LMNA
SCHEMBL30948203 0.87 IL4I1 (0.71) IL4I1TP53ACHE
SCHEMBL30947900 0.85 IL4I1 (0.79) IL4I1RXFP1TP53LMNA
SCHEMBL30047301 0.85 IL4I1 (0.58) IL4I1RXFP1CYP11B1CYP11B2POLB
SCHEMBL30948191 0.85 IL4I1 (0.64) IL4I1RXFP1TP53LMNA
SCHEMBL30046201 0.85 IL4I1 (0.58) IL4I1RXFP1CYP11B1CYP11B2POLB
SCHEMBL30046257 0.85 IL4I1 (1.00) IL4I1RXFP1POLBTP53LMNA

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 1/4885RXFP1 1354/4885CYP11B1 1150/4885

“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.