SCHEMBL29079587

SCHEMBL29079587

Cc1cn(C2CCC(=O)NC2=O)c2cccc(Br)c12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.50
▸ DDB1 Q16531 18/20 0.50
▸ IKZF3 Q9UKT9 6/20 0.50
▸ ALDH1A1 P00352 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ OPRM1 P35372 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ TNF P01375 2/20 0.42
▸ IL1B P01584 2/20 0.42
▸ TBXA2R P21731 1/20 0.40
▸ IKZF1 Q13422 1/20 0.40

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
SCHEMBL26067471 0.84 CRBN (0.47) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31134426 0.81 HTR6 (0.45) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20812174 0.81 CRBN (0.62) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29079566 0.78 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29767993 0.78 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27178337 0.77 CRBN (0.53) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL24881488 0.77 CRBN (0.51) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31134636 0.76 CRBN (0.48) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27267413 0.74 CRBN (0.53) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL26043080 0.73 DDB1 (0.36) CRBNDDB1IKZF3TNFIL1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116648248-B Aromatic compound, pharmaceutical composition containing same and application thereof 成都茵创园医药科技有限公司 2025-04-15 — — CN disclosed
CN-116648248-A Aromatic compound, pharmaceutical composition containing same and application thereof 成都茵创园医药科技有限公司 2023-08-25 — — CN disclosed
WO-2022161414-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND APPLICATION THEREOF 成都茵创园医药科技有限公司 2022-08-04 — — WO disclosed
Send feedback