SCHEMBL29329208

SCHEMBL29329208

N#Cc1cc(OC2CC(OCc3ccccc3)C2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 6/20 0.39
EGFR P00533 3/20 0.33
APP P05067 1/20 0.33
MAPT P10636 1/20 0.33
TTBK1 Q5TCY1 1/20 0.33
TTBK2 Q6IQ55 1/20 0.33
AURKB Q96GD4 1/20 0.33
SYK P43405 2/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSK P43235 1/20 0.33
ESR1 P03372 1/20 0.32
MET P08581 1/20 0.32
PRKCD Q05655 2/20 0.32
RET P07949 1/20 0.32
NAAA Q02083 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
SIRT1 Q96EB6 1/20 0.32
SIRT3 Q9NTG7 1/20 0.32
KDR P35968 2/20 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
SCHEMBL29330430 0.86 PRKCQ (0.43) PRKCQEGFRAPPMAPTTTBK1
SCHEMBL29329290 0.81 PRKCQ (0.42) PRKCQEGFRSYKESR1MET
SCHEMBL29328590 0.80 PRKCQ (0.37) PRKCQEGFRAPPSYKESR1
SCHEMBL29329002 0.80 SYK (0.38) PRKCQEGFRSYKCTSKESR1
SCHEMBL29330567 0.80 PRKCQ (0.45) PRKCQTTBK1TTBK2SYKESR1
SCHEMBL29330345 0.79 PRKCQ (0.38) PRKCQEGFRAPPMAPTTTBK1
SCHEMBL29329367 0.79 PRKCQ (0.40) PRKCQMAPTSYKESR1MET
SCHEMBL29329725 0.78 PRKCQ (0.40) PRKCQEGFRSYKESR1MET
SCHEMBL29329369 0.76 PRKCQ (0.34) PRKCQEGFRAPPSYKESR1
SCHEMBL29330342 0.76 SYK (0.40) PRKCQEGFRAPPSYKESR1

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