SCHEMBL31077418

SCHEMBL31077418

O=C1CCC(N2C(=O)c3cccc(CN4CC5CCC4CN5)c3C2=O)C(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 19/20 0.59
▸ CRBN Q96SW2 19/20 0.59
▸ IKZF3 Q9UKT9 2/20 0.56
▸ TNF P01375 1/20 0.56
▸ IL1B P01584 1/20 0.56
▸ TBXA2R P21731 1/20 0.56
▸ IKZF1 Q13422 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.53
▸ CHRM2 P08172 1/20 0.53
▸ OPRM1 P35372 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL25647213 0.92 DDB1 (0.59) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31076875 0.83 CRBN (0.58) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25647211 0.82 CRBN (0.67) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25647212 0.82 DDB1 (0.63) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25647154 0.82 CRBN (0.54) DDB1CRBNIKZF3ALDH1A1CHRM2
SCHEMBL25647210 0.81 CRBN (0.66) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31033684 0.81 DDB1 (0.61) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25270736 0.80 CRBN (0.70) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31076948 0.80 CRBN (0.70) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25647193 0.80 DDB1 (0.63) DDB1CRBNIKZF3TNFIL1B

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
EP-4446324-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF Gluetacs Therapeutics (Shanghai) Co., Ltd. (CN) 2024-10-16 — — EP claimed
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