SCHEMBL29329432

SCHEMBL29329432

N#Cc1cc(Oc2cccc(C(F)F)c2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 7/20 0.38
MET P08581 1/20 0.35
SYK P43405 3/20 0.34
ESR1 P03372 2/20 0.34
EGFR P00533 2/20 0.33
ERBB2 P04626 1/20 0.33
ERBB3 P21860 1/20 0.33
ERBB4 Q15303 1/20 0.33
CSNK1A1 P48729 1/20 0.32
CSNK1D P48730 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CYP19A1 P11511 1/20 0.32
RET P07949 1/20 0.32
TTBK1 Q5TCY1 1/20 0.31
TTBK2 Q6IQ55 1/20 0.31
PRKCD Q05655 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
SCHEMBL29329641 0.89 SYK (0.35) PRKCQMETSYKESR1EGFR
SCHEMBL29328747 0.86 EGFR (0.42) PRKCQMETSYKESR1EGFR
SCHEMBL29330567 0.86 PRKCQ (0.45) PRKCQSYKESR1CSNK1A1CSNK1D
SCHEMBL29330092 0.85 ABL1 (0.41) PRKCQMETSYKESR1EGFR
SCHEMBL29329720 0.85 TTBK1 (0.46) PRKCQESR1EGFRERBB2ERBB3
SCHEMBL29329431 0.84 SYK (0.39) PRKCQMETSYKESR1EGFR
SCHEMBL29330254 0.83 SYK (0.42) PRKCQMETSYKESR1EGFR
SCHEMBL29330255 0.83 ESR1 (0.42) PRKCQMETSYKESR1RET
SCHEMBL29330251 0.83 SYK (0.41) PRKCQMETSYKESR1EGFR
SCHEMBL29329722 0.82 SYK (0.41) PRKCQMETSYKESR1EGFR

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