SCHEMBL22923912

SCHEMBL22923912

Cc1c(CCN(C)C)cn(-c2ccc(F)cc2)c(=O)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HTR7 P34969 3/20 0.42
TAAR1 Q96RJ0 1/20 0.38
RECQL P46063 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
KCNH2 Q12809 1/20 0.36
METAP2 P50579 2/20 0.36

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
SCHEMBL22923934 0.93 KDM4E (0.39) LMNAKDM4EHTR7RECQLL3MBTL1
SCHEMBL22923932 0.82 MEN1 (0.43) LMNAKDM4EMEN1KMT2A
SCHEMBL22923869 0.81 MTNR1A (0.42) LMNAKDM4EMEN1KMT2AMETAP2
SCHEMBL22923883 0.80 KDM4E (0.40) LMNAKDM4EKCNH2
SCHEMBL22923941 0.78 MAPT (0.38) LMNAKDM4ERECQLL3MBTL1MEN1
SCHEMBL30367422 0.77 LMNA (0.51) LMNAKDM4ERECQLL3MBTL1MEN1
SCHEMBL22923858 0.75 LMNA (0.49) LMNAKDM4ERECQLL3MBTL1MEN1
SCHEMBL22923879 0.75 LMNA (0.49) LMNAKDM4ERECQLL3MBTL1MEN1
SCHEMBL22923870 0.74 MEN1 (0.48) LMNAKDM4EL3MBTL1MEN1KMT2A
SCHEMBL22923863 0.72 LMNA (0.52) LMNAKDM4ERECQLL3MBTL1MEN1

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-2021012717-A1 ANTITUMOR COMPOUND USED AS AXL INHIBITOR AND USE THEREOF 南京华威医药科技集团有限公司 2021-01-28 WO disclosed