SCHEMBL29329532

SCHEMBL29329532

N#Cc1cc(Oc2ccc(F)c(OC(F)(F)F)c2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.38
BCR P11274 2/20 0.38
KDR P35968 4/20 0.38
BRAF P15056 2/20 0.38
SYK P43405 2/20 0.37
PRKCQ Q04759 5/20 0.37
MET P08581 1/20 0.35
TRPA1 O75762 1/20 0.34
ESR1 P03372 1/20 0.33
BTK Q06187 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
RET P07949 1/20 0.32
PRKCD Q05655 1/20 0.32
ROCK2 O75116 1/20 0.32

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
SCHEMBL29329642 0.89 ABL1 (0.46) ABL1BCRSYKPRKCQESR1
SCHEMBL29330254 0.88 SYK (0.42) SYKPRKCQMETTRPA1ESR1
SCHEMBL29329538 0.87 SYK (0.39) KDRBRAFSYKPRKCQMET
SCHEMBL29330092 0.87 ABL1 (0.41) ABL1BCRKDRBRAFSYK
SCHEMBL29329717 0.85 ESR1 (0.39) ABL1BCRKDRBRAFSYK
SCHEMBL29328660 0.85 SYK (0.39) ABL1BCRKDRBRAFSYK
SCHEMBL29330164 0.85 SYK (0.40) KDRBRAFSYKPRKCQMET
SCHEMBL29330032 0.85 SYK (0.42) ABL1BCRSYKPRKCQMET
SCHEMBL29330255 0.83 ESR1 (0.42) SYKPRKCQMETESR1RET
SCHEMBL29330251 0.83 SYK (0.41) ABL1BCRSYKPRKCQMET

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