SCHEMBL30194933

SCHEMBL30194933

CC(C)N(C(=O)c1c(P(C2CCCCC2)C2CCCCC2)cnn1C)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ CNR1 P21554 2/20 0.31
▸ CNR2 P34972 2/20 0.31
▸ PDE10A Q9Y233 2/20 0.31
▸ HSD11B1 P28845 1/20 0.31

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
SCHEMBL29227813 0.85 S1PR3 (0.39) LMNA
SCHEMBL30194971 0.81 CHRM4 (0.38) ALDH1A1POLBPDE10A
SCHEMBL30195140 0.70 LMNA (0.55) LMNAPOLB
SCHEMBL27729055 0.68 TSHR (0.37) POLB
SCHEMBL30194977 0.62 LMNA (0.52) LMNAPOLB
SCHEMBL16596946 0.61 LMNA (0.45) LMNAALDH1A1POLBCNR1CNR2
SCHEMBL16596945 0.60 PTGES (0.41) LMNAALDH1A1CNR2
SCHEMBL16596912 0.58 PTGES (0.42) LMNAALDH1A1
SCHEMBL23844194 0.57 KAT2B (0.50) ALDH1A1CNR2PDE10A
SCHEMBL30960385 0.57 LMNA (0.38) LMNAALDH1A1POLB

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-115703806-B Phosphine ligand of pyrazole-amide framework, and preparation method and application thereof 香港理工大学深圳研究院 2024-05-14 — — CN disclosed
CN-115703806-A Phosphine ligand with pyrazole-amide skeleton and preparation method and application thereof 香港理工大学深圳研究院 2023-02-17 — — CN disclosed
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