SCHEMBL22182174

SCHEMBL22182174

CC(=O)Nc1cc(B2OC(C)(C)C(C)(C)O2)cc(-c2ccc(F)cc2F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.43
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
CNR1 P21554 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PDGFRB P09619 2/20 0.37
KDR P35968 2/20 0.37
IDO1 P14902 1/20 0.36
HDAC1 Q13547 3/20 0.36
HDAC3 O15379 1/20 0.36
HDAC2 Q92769 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
CA1 P00915 2/20 0.35

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
SCHEMBL22792766 0.87 PDGFRB (0.40) SMN1; SMN2PDGFRBKDRLMNA
SCHEMBL22792755 0.84 LPL (0.43) LPLLIPGCNR1PDGFRBKDR
SCHEMBL22182243 0.83 LPL (0.42) LPLLIPGIDO1CA1CA2
SCHEMBL22182206 0.81 FGFR1 (0.42) FGFR1LPLLIPGIDO1CA1
SCHEMBL16655918 0.80 LPL (0.41) LPLLIPGGAAPDGFRBKDR
SCHEMBL16342432 0.79 FGFR1 (0.65) FGFR1KDR
SCHEMBL22182214 0.79 LPL (0.40) LPLLIPGIDO1CXCR2
SCHEMBL22182428 0.78 FGFR1 (0.44) FGFR1LPLLIPGKDRIDO1
SCHEMBL22792514 0.77 LPL (0.48) LPLLIPGALDH1A1PDGFRBKDR
SCHEMBL22182173 0.75 FGFR1 (0.48) FGFR1SMN1; SMN2GAACNR1KDM4E

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-2020135878-A1 IMIDAZOPYRIDINE DERIVATIVE AS FGFR AND VEGFR DUAL INHIBITOR 南京明德新药研发有限公司 2020-07-02 WO disclosed