SCHEMBL31099178

SCHEMBL31099178

O=C1CCc2ccccc2N1c1cc(OC2CCNCC2)c([N+](=O)[O-])cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 3/20 0.41
▸ BCOR Q6W2J9 3/20 0.41
▸ UTS2R Q9UKP6 1/20 0.37
▸ HTR2C P28335 5/20 0.37
▸ KCNH2 Q12809 4/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ MAPT P10636 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ HTR1E P28566 1/20 0.36
▸ AVPR2 P30518 1/20 0.36
▸ OXTR P30559 1/20 0.36
▸ HTR1F P30939 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ ADRA1A P35348 1/20 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
SCHEMBL83015 0.68 HRH1 (0.54) SMN1; SMN2HTR1A
SCHEMBL29874183 0.67 BCL6 (0.84) BCL6BCORSMN1; SMN2
SCHEMBL23249972 0.67 BCL6 (0.84) BCL6BCORSMN1; SMN2
Hydrochloric Acid SCHEMBL70340 0.67 HRH1 (0.53) SMN1; SMN2HTR1A
SCHEMBL3973922 0.64 UTS2R (0.52) UTS2RMAPTSMN1; SMN2KMT2AMEN1
SCHEMBL17304048 0.62 BCL6 (0.44) BCL6BCORMAPTSMN1; SMN2KMT2A
SCHEMBL17154906 0.62 SLC6A2 (0.49) HTR1A
SCHEMBL22493009 0.61 ALDH1A1 (0.56) MAPTSMN1; SMN2DRD3KMT2AMEN1
SCHEMBL29510718 0.61 ALDH1A1 (0.56) MAPTSMN1; SMN2DRD3KMT2AMEN1
SCHEMBL82955 0.61 HRH1 (0.62) HTR2CKCNH2HTR2AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119019369-A Bifunctional molecules comprising an E3 ubiquitin ligase binding moiety linked to a BCL6 targeting moiety 阿尔维纳斯运营股份有限公司 2024-11-26 — — CN disclosed
CN-115397821-B Bifunctional molecules comprising an E3 ubiquitin ligase binding moiety linked to a BCL6 targeting moiety 阿尔维纳斯运营股份有限公司 2024-09-03 — — CN disclosed
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