SCHEMBL30948130

SCHEMBL30948130

O=C1C(=O)N(C2CCCC2)CCN1Cc1cc(-c2ccccc2F)on1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 6/20 0.63
ACKR3 P25106 5/20 0.48
RXFP1 Q9HBX9 1/20 0.41
TP53 P04637 2/20 0.38
LMNA P02545 2/20 0.37
KCNH2 Q12809 1/20 0.37
SCN9A Q15858 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
SCHEMBL30948132 0.86 IL4I1 (0.68) IL4I1RXFP1
SCHEMBL30948234 0.84 IL4I1 (0.65) IL4I1RXFP1
SCHEMBL30948026 0.82 IL4I1 (0.76) IL4I1ACKR3RXFP1TP53LMNA
SCHEMBL27163527 0.80 IL4I1 (0.55) IL4I1RXFP1TP53
SCHEMBL30948277 0.80 IL4I1 (0.72) IL4I1ACKR3RXFP1TP53LMNA
SCHEMBL30948288 0.80 IL4I1 (0.96) IL4I1RXFP1TP53LMNAKCNH2
SCHEMBL30948149 0.79 IL4I1 (0.69) IL4I1RXFP1TP53LMNA
SCHEMBL30948331 0.77 IL4I1 (0.68) IL4I1RXFP1TP53LMNASCN9A
SCHEMBL30046257 0.77 IL4I1 (1.00) IL4I1RXFP1TP53LMNAKCNH2
SCHEMBL27163220 0.77 IL4I1 (1.00) IL4I1RXFP1TP53LMNAKCNH2

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 1/4885ACKR3 1843/4885RXFP1 1354/4885

“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.