SCHEMBL29045852

SCHEMBL29045852

Clc1ccccc1COc1ccc(OCCOCCNC2CCCCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FOXM1 Q08050 2/20 0.69
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ KDM4E B2RXH2 6/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ KMT2A Q03164 4/20 0.48
▸ LMNA P02545 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ MITF O75030 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ NR4A2 P43354 1/20 0.42
▸ MAOB P27338 2/20 0.41
▸ MAOA P21397 1/20 0.41

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
SCHEMBL29045837 0.99 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL12204774 0.85 FOXM1 (0.49) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045827 0.85 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045854 0.85 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045791 0.85 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045787 0.85 FOXM1 (0.70) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045833 0.83 FOXM1 (0.97) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045785 0.83 FOXM1 (0.97) FOXM1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL29045860 0.83 FOXM1 (0.67) 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 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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