SCHEMBL30948020

SCHEMBL30948020

O=c1c(=O)n(C2CCCC2)ccn1Cc1ccc(-c2ccccc2)nn1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 9/20 0.63
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ACHE P22303 2/20 0.34
ALDH1A1 P00352 1/20 0.34
SRC P12931 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL27163789 0.98 IL4I1 (0.64) IL4I1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL30047237 0.98 IL4I1 (0.64) IL4I1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL30948249 0.87 IL4I1 (0.49) IL4I1CYP11B1CYP11B2
SCHEMBL30948078 0.87 IL4I1 (0.65) IL4I1CYP11B1CYP11B2ALDH1A1
SCHEMBL30947909 0.85 IL4I1 (0.62) IL4I1CYP11B1CYP11B2
SCHEMBL30947966 0.84 IL4I1 (0.67) IL4I1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL30948348 0.83 IL4I1 (0.62) IL4I1CYP11B1CYP11B2ALDH1A1SRC
SCHEMBL30948097 0.82 IL4I1 (0.70) IL4I1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL30948219 0.81 IL4I1 (0.57) IL4I1
SCHEMBL30947915 0.81 IL4I1 (0.51) IL4I1ALDH1A1CNR1CNR2

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 1/4885CYP11B1 1150/4885CYP11B2 1452/4885

“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.