SCHEMBL31612902

SCHEMBL31612902

O=C1CCC(n2ncc3cc(N4CCNCC4)ccc32)C(=O)N1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 16/20 0.62
DDB1 Q16531 15/20 0.62
ABL1 P00519 1/20 0.44
IKZF3 Q9UKT9 4/20 0.40
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR5A P47898 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
CHRM2 P08172 1/20 0.37
OPRM1 P35372 1/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL31612900 1.00 CRBN (0.62) CRBNDDB1ABL1IKZF3HTR3E
Trifluoroacetic Acid SCHEMBL30768701 0.91 CRBN (0.53) CRBNDDB1ABL1IKZF3
SCHEMBL24861073 0.88 CRBN (0.53) CRBNDDB1ABL1IKZF3HTR3E
Hydrochloric Acid SCHEMBL31331017 0.87 CRBN (0.52) CRBNDDB1ABL1HTR3EHTR3B
SCHEMBL24861134 0.86 CRBN (0.53) CRBNDDB1ABL1IKZF3HTR3E
SCHEMBL31672239 0.86 CRBN (0.53) CRBNDDB1ABL1IKZF3HTR3E
SCHEMBL29799923 0.83 CRBN (0.57) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27223003 0.83 CRBN (0.57) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20231966 0.81 CRBN (0.51) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31690362 0.81 CRBN (0.47) CRBNDDB1ABL1ALDH1A1LMNA

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
CN-120118067-A Estrogen receptor modulators and uses thereof 江苏威凯尔医药科技股份有限公司 2025-06-10 CN disclosed