SCHEMBL29648313

SCHEMBL29648313

CN1C(=O)CCC(N2C(=O)c3ccc(N4CCN(CCC5CCNCC5)CC4)cc3C2=O)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IRAK1 P51617 2/20 0.49
▸ IRAK3 Q9Y616 2/20 0.49
▸ CRBN Q96SW2 7/20 0.45
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CCNC P24863 1/20 0.39
▸ CDK8 P49336 1/20 0.39
▸ NTRK3 Q16288 1/20 0.39
▸ HASPIN Q8TF76 1/20 0.39
▸ CDK19 Q9BWU1 1/20 0.39
▸ IRAK4 Q9NWZ3 1/20 0.39
▸ HTR7 P34969 1/20 0.38
▸ HPGDS O60760 1/20 0.37
▸ STAT3 P40763 1/20 0.36
▸ DRD4 P21917 4/20 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
SCHEMBL24501659 1.00 IRAK1 (0.49) IRAK1IRAK3CRBNMEN1ALDH1A1
SCHEMBL30962345 0.92 CRBN (0.46) IRAK1IRAK3CRBNMEN1ALDH1A1
SCHEMBL29648286 0.86 CRBN (0.54) IRAK1IRAK3CRBNMEN1ALDH1A1
SCHEMBL24501060 0.86 CRBN (0.54) IRAK1IRAK3CRBNMEN1ALDH1A1
SCHEMBL29648377 0.84 CRBN (0.67) IRAK1IRAK3CRBNALDH1A1CCNC
SCHEMBL22290046 0.84 CRBN (0.67) IRAK1IRAK3CRBNALDH1A1CCNC
SCHEMBL24501729 0.84 CRBN (0.67) IRAK1IRAK3CRBNALDH1A1CCNC
Hydrochloric Acid SCHEMBL31373761 0.83 CRBN (0.66) IRAK1IRAK3CRBNALDH1A1CCNC
SCHEMBL24501045 0.83 IRAK1 (0.53) IRAK1IRAK3CRBNCCNCCDK8
SCHEMBL29648294 0.83 IRAK1 (0.53) IRAK1IRAK3CRBNCCNCCDK8

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
WO-2022120355-A1 TEAD DEGRADERS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 — — WO disclosed
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