SCHEMBL27164232

SCHEMBL27164232

O=C1C(=O)N(C2CCC(c3ccccc3)C2)CCN1Cc1nnc(-c2ccccc2)s1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 8/20 0.61
RXFP1 Q9HBX9 1/20 0.38
POLB P06746 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
BRD4 O60885 1/20 0.36
TP53 P04637 1/20 0.35
SCN9A Q15858 1/20 0.35
DGAT1 O75907 1/20 0.35
TRPV6 Q9H1D0 2/20 0.34
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33

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
SCHEMBL27164223 1.00 IL4I1 (0.61) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL27164229 1.00 IL4I1 (0.61) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL30046025 0.99 IL4I1 (0.60) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL27163079 0.85 IL4I1 (0.74) IL4I1RXFP1POLBHRH3TP53
SCHEMBL27163306 0.85 IL4I1 (0.77) IL4I1RXFP1POLBHRH3TP53
SCHEMBL30948225 0.85 IL4I1 (0.62) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL30947971 0.84 IL4I1 (0.61) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL30948340 0.83 IL4I1 (0.60) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL30947926 0.83 IL4I1 (0.63) IL4I1RXFP1POLBHRH3BRD4
SCHEMBL30947901 0.81 IL4I1 (0.57) IL4I1RXFP1POLBHRH3TP53

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 2 patents. 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
EP-4329889-A1 IL4I1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2024-03-06 EP 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 1354/4885POLB 2929/4885

“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.