SCHEMBL30948260

SCHEMBL30948260

O=C1C(=O)N(C23CC(F)(C2)C3)CCN1Cc1ccc(-c2ccccn2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 3/20 0.46
CNR2 P34972 1/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
P2RX7 Q99572 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC1 Q13547 1/20 0.34
GRM2 Q14416 1/20 0.33
PORCN Q9H237 1/20 0.33
HCRTR2 O43614 2/20 0.33
MAPT P10636 1/20 0.33
GRM4 Q14833 1/20 0.33
HCRTR1 O43613 1/20 0.33
PRMT5 O14744 1/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32
EGLN1 Q9GZT9 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL30948088 0.82 IL4I1 (0.40) IL4I1DDB1CRBNP2RX7MAPT
SCHEMBL30948347 0.80 IL4I1 (0.39) IL4I1DDB1CRBNPRMT5
SCHEMBL30947936 0.78 IL4I1 (0.38) IL4I1HCRTR2HCRTR1PRMT5ALDH1A1
SCHEMBL30948194 0.78 CA12 (0.47) IL4I1P2RX7HCRTR2MAPT
SCHEMBL30948108 0.77 IL4I1 (0.41) IL4I1DDB1CRBNP2RX7HCRTR2
SCHEMBL30947928 0.76 IL4I1 (0.60) IL4I1PORCNMAPTPRMT5MEN1
SCHEMBL30948295 0.76 GSK3B (0.39) IL4I1HCRTR2HCRTR1
SCHEMBL30948202 0.75 IL4I1 (0.40) IL4I1CNR2DDB1CRBNHDAC6
SCHEMBL30948269 0.74 IL4I1 (0.69) IL4I1HDAC6HDAC1GRM2PORCN
SCHEMBL30948186 0.73 IL4I1 (0.62) IL4I1P2RX7GRM2

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 1/4885CNR2 3878/4885DDB1 3807/4885

“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.