SCHEMBL931950

SCHEMBL931950

Oc1ccccc1C1C=CC=CC1(F)Cl

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
NPC1 O15118 1/20 0.30
CA12 O43570 1/20 0.30
GMNN O75496 1/20 0.30
ALDH1A1 P00352 1/20 0.30
EGFR P00533 1/20 0.30
CA2 P00918 1/20 0.30
LMNA P02545 1/20 0.30
FYN P06241 1/20 0.30
POLB P06746 1/20 0.30
CA3 P07451 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
MMP9 P14780 1/20 0.30

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
SCHEMBL17241784 0.81 KDM4E (0.30) KDM4EMEN1KMT2A
SCHEMBL4609631 0.81 MEN1 (0.34) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL31210013 0.73 KDM4E (0.33) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL2050221 0.67 MEN1 (0.38) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL27642717 0.66 MAPT (0.43) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL24343229 0.64 PPIA (0.33)
SCHEMBL2049681 0.63 MEN1 (0.41) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL24704597 0.62
SCHEMBL2050402 0.62 MEN1 (0.40) KDM4EMEN1KMT2AGAAHTR2A
SCHEMBL23203046 0.62 CHRNA7 (0.31)

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
WO-2011002408-A1 NOVEL COMPOUNDS FOR TREATMENT OF NEURODEGENERATION ASSOCIATED WITH DISEASES, SUCH AS ALZHEIMER'S DISEASE OR DEMENTIA ASTRAZENECA AB (SE) 2011-01-06 WO claimed