SCHEMBL25398482

SCHEMBL25398482

Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(OCCN4CCOCC4)nc3)nc21

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 17/20 0.72
EGFR P00533 8/20 0.72
SRC P12931 11/20 0.70
PDGFRB P09619 7/20 0.70
PDGFRA P16234 7/20 0.70
SLC2A1 P11166 1/20 0.70
PKMYT1 Q99640 1/20 0.70
WEE1 P30291 2/20 0.69
FGFR2 P21802 3/20 0.67
FGFR4 P22455 3/20 0.67
FGFR3 P22607 3/20 0.67
ABL1 P00519 5/20 0.62
MAPK14 Q16539 5/20 0.62
KIT P10721 3/20 0.62

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
SCHEMBL30618362 1.00 FGFR1 (0.72) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL30618274 0.91 FGFR1 (0.72) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL30618267 0.91 FGFR1 (0.72) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL25398991 0.91 FGFR1 (0.72) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL25399633 0.91 FGFR1 (0.72) FGFR1EGFRSRCPDGFRBPDGFRA
Formic Acid SCHEMBL30618335 0.90 WEE1 (0.60) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL25435326 0.90 FGFR1 (0.71) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL30618250 0.90 FGFR1 (0.71) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL25435935 0.89 FGFR1 (0.70) FGFR1EGFRSRCPDGFRBPDGFRA
SCHEMBL30618248 0.89 FGFR1 (0.70) FGFR1EGFRSRCPDGFRBPDGFRA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023177356-A2 COMPOUNDS AND METHOD FOR PKMYT1 INHIBITION ENGINE BIOSCIENCES PTE. LTD. (SG) 2023-09-21 WO disclosed
WO-2023177356-A2 COMPOUNDS AND METHOD FOR PKMYT1 INHIBITION ENGINE BIOSCIENCES PTE. LTD. (SG) 2023-09-21 WO disclosed