SCHEMBL24619868

SCHEMBL24619868

CCOc1cccc(Cc2ccccc2CN2CCN(c3ccc(C(=O)NSc4ccc(NCCSc5ccccc5)c(C(F)(F)F)c4)cc3)CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 12/20 0.39
▸ BCL2 P10415 7/20 0.39
▸ BCL2L2 Q92843 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ FAAH O00519 1/20 0.37
▸ MAPT P10636 4/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ITGB3 P05106 1/20 0.36
▸ ITGA2B P08514 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ TSHR P16473 1/20 0.35

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
SCHEMBL24629034 0.90 BCL2L1 (0.43) BCL2L1BCL2BCL2L2
SCHEMBL24619782 0.85 BCL2L1 (0.40) BCL2L1BCL2BCL2L2
SCHEMBL24619957 0.83 BCL2L1 (0.42) BCL2L1BCL2BCL2L2FAAHLMNA
SCHEMBL26657574 0.79 BCL2L1 (0.55) BCL2L1BCL2BCL2L2
SCHEMBL30963852 0.79 BCL2L1 (0.55) BCL2L1BCL2BCL2L2
SCHEMBL26680621 0.78 BCL2L1 (0.50) BCL2L1BCL2BCL2L2
SCHEMBL26682810 0.78 BCL2L1 (0.51) BCL2L1BCL2BCL2L2
SCHEMBL26681515 0.77 BCL2L1 (0.49) BCL2L1BCL2BCL2L2
SCHEMBL26680715 0.76 BCL2L1 (0.51) BCL2L1BCL2BCL2L2
SCHEMBL26680772 0.76 BCL2L1 (0.49) BCL2L1BCL2BCL2L2

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-2022149618-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP 中外製薬株式会社 2022-07-14 — — WO disclosed
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