SCHEMBL29329440

SCHEMBL29329440

N#Cc1cc(Oc2cc(F)cc(F)c2F)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.40
SYK P43405 3/20 0.39
PRKCQ Q04759 5/20 0.37
ESR1 P03372 4/20 0.34
RET P07949 1/20 0.34
AHR P35869 1/20 0.33
EGFR P00533 2/20 0.31
PRKCD Q05655 1/20 0.31
ROCK2 O75116 1/20 0.31
SCN9A Q15858 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
ERBB2 P04626 1/20 0.31
ERBB3 P21860 1/20 0.31
ERBB4 Q15303 1/20 0.31

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
SCHEMBL29329638 0.89 MET (0.47) METSYKPRKCQESR1AHR
SCHEMBL29330032 0.89 SYK (0.42) METSYKPRKCQESR1RET
SCHEMBL29329639 0.89 MET (0.43) METSYKPRKCQESR1RET
SCHEMBL29330251 0.88 SYK (0.41) METSYKPRKCQESR1RET
SCHEMBL29329719 0.87 MET (0.41) METSYKPRKCQESR1RET
SCHEMBL29329781 0.87 SYK (0.41) METSYKPRKCQESR1RET
SCHEMBL29330255 0.86 ESR1 (0.42) METSYKPRKCQESR1RET
SCHEMBL29330031 0.86 MET (0.42) METSYKPRKCQESR1RET
SCHEMBL29329536 0.85 SYK (0.40) METSYKPRKCQESR1RET
SCHEMBL29330254 0.84 SYK (0.42) METSYKPRKCQESR1RET

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-2024151919-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2024-07-18 WO disclosed