SCHEMBL23587155

SCHEMBL23587155

CCOC(O)CC(C(=O)c1cccc2ccccc12)c1ccncc1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.37
CNR2 P34972 3/20 0.37
CNR1 P21554 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35
HDAC2 Q92769 1/20 0.35
KDM4E B2RXH2 2/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL16092088 0.82 CDC25B (0.43) CDC25BCNR2CNR1MEN1KMT2A
SCHEMBL16061985 0.74 CYP1A2 (0.42) CNR2CNR1KMT2AALDH1A1L3MBTL1
SCHEMBL2475368 0.68 GAA (0.35) ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL16092097 0.66 CDC25B (0.48) CDC25BCNR2CNR1MEN1KMT2A
SCHEMBL16092091 0.66 PTPN1 (0.48) CNR2CNR1MEN1KMT2AALDH1A1
SCHEMBL16061977 0.65 CCNC (0.40) CNR2MEN1KMT2AALDH1A1HPGD
SCHEMBL27738535 0.63 LOXL2 (0.37) THRBPOLB
SCHEMBL29702036 0.61 CDC25B (0.57) CDC25BMEN1KMT2AALDH1A1CYP1A2
SCHEMBL26117107 0.61 CDC25B (0.57) CDC25BMEN1KMT2AALDH1A1HPGD
SCHEMBL25310527 0.61 CES2 (0.46) KMT2AALDH1A1L3MBTL1HPGDKDM4E

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
EP-3842424-A1 MAP KINASE MODULATORS AND USES THEREOF IN THE TRETAMENT OF TAUOPATHIES The Trustees of Columbia University in the City of New York (US) 2021-06-30 EP disclosed