SCHEMBL30948229

SCHEMBL30948229

O=C1C(=O)N(C2CCCC2)CCN1Cc1cc(-c2cccc(F)c2)no1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 7/20 0.79
EPHX2 P34913 2/20 0.41
PDE4A P27815 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
TP53 P04637 1/20 0.38
GRM5 P41594 6/20 0.38
KCNH2 Q12809 1/20 0.38
GRM2 Q14416 1/20 0.38

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
SCHEMBL30948059 0.98 IL4I1 (0.76) IL4I1EPHX2PDE4AMAPTSMN1; SMN2
SCHEMBL30948292 0.89 IL4I1 (0.80) IL4I1EPHX2MAPTSMN1; SMN2RXFP1
SCHEMBL27163698 0.89 IL4I1 (1.00) IL4I1MAPTSMN1; SMN2RXFP1
SCHEMBL30948240 0.87 IL4I1 (0.77) IL4I1EPHX2MAPTSMN1; SMN2RXFP1
SCHEMBL30947922 0.86 IL4I1 (0.96) IL4I1MAPTSMN1; SMN2RXFP1
SCHEMBL30948026 0.84 IL4I1 (0.76) IL4I1MAPTSMN1; SMN2RXFP1TP53
SCHEMBL30948277 0.82 IL4I1 (0.72) IL4I1MAPTSMN1; SMN2RXFP1TP53
SCHEMBL30948266 0.81 IL4I1 (1.00) IL4I1PDE4ARXFP1TP53KCNH2
SCHEMBL30948042 0.79 IL4I1 (0.50) IL4I1EPHX2MAPTSMN1; SMN2KCNH2
SCHEMBL30947977 0.79 IL4I1 (0.96) IL4I1PDE4ARXFP1TP53KCNH2

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 1/4885EPHX2 3776/4885PDE4A 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.