SCHEMBL29045781

SCHEMBL29045781

Fc1ccc(COc2ccc(OCCOCCNC3CCCC3)cc2)cc1F

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOXM1 Q08050 2/20 0.71
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ KDM4E B2RXH2 7/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.46
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.40
▸ APP P05067 2/20 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
SCHEMBL29986109 1.00 FOXM1 (0.71) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045788 0.87 FOXM1 (0.77) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29985464 0.85 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045816 0.85 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045862 0.84 FOXM1 (0.98) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045840 0.84 FOXM1 (0.75) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29985698 0.84 FOXM1 (0.75) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045801 0.83 FOXM1 (0.79) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045845 0.83 FOXM1 (0.97) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045824 0.82 FOXM1 (0.95) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6

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-115304502-A FOXM1 inhibitor and preparation method and application thereof 中国医学科学院医药生物技术研究所 2022-11-08 — — CN disclosed
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