SCHEMBL29329536

SCHEMBL29329536

N#Cc1cc(Oc2c(F)c(F)c(F)c(F)c2F)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.40
PRKCQ Q04759 6/20 0.38
ESR1 P03372 4/20 0.37
MET P08581 1/20 0.36
RET P07949 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
EGFR P00533 1/20 0.34
PRKCD Q05655 1/20 0.33
AHR P35869 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 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
SCHEMBL29329781 0.94 SYK (0.41) SYKPRKCQESR1METRET
SCHEMBL29329863 0.91 SYK (0.40) SYKPRKCQESR1METRET
SCHEMBL29329722 0.90 SYK (0.41) SYKPRKCQESR1METRET
SCHEMBL29330032 0.89 SYK (0.42) SYKPRKCQESR1METRET
SCHEMBL29330255 0.88 ESR1 (0.42) SYKPRKCQESR1METRET
SCHEMBL29330251 0.88 SYK (0.41) SYKPRKCQESR1METRET
SCHEMBL29330254 0.86 SYK (0.42) SYKPRKCQESR1METRET
SCHEMBL29329719 0.85 MET (0.41) SYKPRKCQESR1METRET
SCHEMBL29330341 0.85 PRKCQ (0.39) SYKPRKCQESR1METRET
SCHEMBL29330567 0.85 PRKCQ (0.45) SYKPRKCQESR1RETMEN1

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