SCHEMBL30410197

SCHEMBL30410197

O=C1CCC(N2C(=O)c3cc(Br)cc4c3C2CCC4)C(=O)N1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.51
▸ DDB1 Q16531 5/20 0.51
▸ ALDH1A1 P00352 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ IKZF3 Q9UKT9 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL25138069 1.00 CRBN (0.51) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25138136 0.82 CRBN (0.42) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24317375 0.81 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25138190 0.73 CRBN (0.50) CRBNDDB1IKZF3
SCHEMBL21208002 0.71 CRBN (0.60) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL13881718 0.70 CRBN (0.59) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25137979 0.69 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25137954 0.69 CRBN (0.50) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL26103591 0.68 CRBN (0.60) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25036281 0.68 CRBN (0.51) CRBNDDB1ALDH1A1CHRM2OPRM1

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-2023061478-A1 TRICYCLIC COMPOUND 先声再明医药有限公司 2023-04-20 — — WO disclosed
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