SCHEMBL30948160

SCHEMBL30948160

O=C1C(=O)N(C2CC3CC3C2)CCN1Cc1nnc(-c2ccc(F)cc2)s1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 8/20 0.62
RXFP1 Q9HBX9 1/20 0.44
LMNA P02545 2/20 0.43
TP53 P04637 5/20 0.41
HRH3 Q9Y5N1 1/20 0.39
PDE4A P27815 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
SCHEMBL30947971 0.89 IL4I1 (0.61) IL4I1RXFP1LMNATP53HRH3
SCHEMBL30948159 0.88 IL4I1 (0.74) IL4I1RXFP1LMNATP53HRH3
SCHEMBL30948085 0.88 IL4I1 (0.78) IL4I1RXFP1LMNATP53HRH3
SCHEMBL30948131 0.88 IL4I1 (0.80) IL4I1RXFP1LMNAHRH3PDE4A
SCHEMBL30948310 0.85 IL4I1 (0.56) IL4I1RXFP1LMNAHRH3
SCHEMBL30948225 0.85 IL4I1 (0.62) IL4I1RXFP1LMNATP53HRH3
SCHEMBL30947926 0.82 IL4I1 (0.63) IL4I1RXFP1LMNATP53HRH3
SCHEMBL30948340 0.80 IL4I1 (0.60) IL4I1RXFP1TP53HRH3
SCHEMBL30948224 0.78 IL4I1 (0.47) IL4I1RXFP1LMNATP53
SCHEMBL30948032 0.77 IL4I1 (0.49) IL4I1RXFP1LMNAHRH3

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 1354/4885LMNA 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.