SCHEMBL29045822

SCHEMBL29045822

c1ccc(COc2ccc(OCCOCCNC3CCC3)cc2)cc1

nearest known ligand 0.95

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOXM1 Q08050 2/20 0.95
KDM4E B2RXH2 6/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
KMT2A Q03164 2/20 0.66
ALDH1A1 P00352 3/20 0.56
MEN1 O00255 1/20 0.56
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
SLC2A1 P11166 1/20 0.49
LTA4H P09960 1/20 0.47
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL29045813 0.97 FOXM1 (1.00) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045833 0.96 FOXM1 (0.97) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045845 0.96 FOXM1 (0.97) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045785 0.96 FOXM1 (0.97) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045824 0.95 FOXM1 (0.95) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045778 0.95 FOXM1 (0.90) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045839 0.89 FOXM1 (0.85) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045801 0.86 FOXM1 (0.79) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045847 0.85 FOXM1 (0.79) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL29045805 0.85 FOXM1 (0.77) FOXM1KDM4ESMN1; SMN2KMT2AALDH1A1

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