SCHEMBL29178795

SCHEMBL29178795

C=Cc1c(-c2ncc(N)cc2C)n(-c2ccc(OCc3ccccc3)c(F)c2)c2c(NCc3ccc(OC)cc3)ncnc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
EGFR P00533 4/20 0.36
POLB P06746 2/20 0.36
NR2F2 P24468 1/20 0.36
MAPT P10636 4/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
JAK3 P52333 1/20 0.35
BTK Q06187 1/20 0.35
TP53 P04637 3/20 0.34
PDE5A O76074 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
MAPK1 P28482 1/20 0.33
OXTR P30559 1/20 0.33
CHRM4 P08173 2/20 0.33

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
SCHEMBL29178646 0.91 EGFR (0.39) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL29178822 0.88 MAPT (0.38) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL30739406 0.88 MAPT (0.38) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL30739169 0.87 EGFR (0.40) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL29178907 0.87 EGFR (0.40) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL30739343 0.86 EGFR (0.39) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL29178699 0.86 EGFR (0.39) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL29178641 0.85 EGFR (0.41) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL29178921 0.85 EGFR (0.38) LMNAEGFRPOLBNR2F2MAPT
SCHEMBL30739337 0.84 PDK1 (0.32) MAPTMEN1KMT2A

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
CN-117466897-A Highly selective FGFR2 inhibitors 深圳福沃药业有限公司 2024-01-30 CN disclosed