SCHEMBL29985698

SCHEMBL29985698

Clc1ccc(COc2ccc(OCCOCCNC3CCCC3)cc2)cc1Cl

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FOXM1 Q08050 2/20 0.75
▸ 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
▸ SIGMAR1 Q99720 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ S1PR1 P21453 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ S1PR5 Q9H228 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 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
SCHEMBL29045840 1.00 FOXM1 (0.75) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045862 0.87 FOXM1 (0.98) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045821 0.85 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29985851 0.85 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29986109 0.84 FOXM1 (0.71) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045781 0.84 FOXM1 (0.71) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045801 0.83 FOXM1 (0.79) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045845 0.83 FOXM1 (0.97) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045827 0.83 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045805 0.82 FOXM1 (0.77) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115304502-B FOXM1 inhibitor and preparation method and application thereof 中国医学科学院医药生物技术研究所 2024-10-18 — — CN disclosed
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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