SCHEMBL30889347

SCHEMBL30889347

CCCCCc1cc(CCCCC)c(CCCCC)o1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
ALOX15 P16050 2/20 0.41
ELANE P08246 3/20 0.40
CYP3A4 P08684 2/20 0.39
ALOX5 P09917 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
TYR P14679 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
HCAR2 Q8TDS4 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PTGS2 P35354 2/20 0.36
LIPG Q9Y5X9 1/20 0.36
TLR8 Q9NR97 1/20 0.36

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
SCHEMBL30889343 0.98 MAPT (0.45) MAPTALOX15ELANECYP3A4ALOX5
SCHEMBL29958550 0.98 MAPT (0.45) MAPTALOX15ELANECYP3A4ALOX5
SCHEMBL30889348 0.98 MAPT (0.45) MAPTALOX15ELANECYP3A4ALOX5
SCHEMBL30889342 0.94 TLR8 (0.40) MAPTALOX15ELANEMEN1TYR
SCHEMBL30318954 0.80 HCAR2 (0.38) MAPTALOX15ELANECYP3A4ALOX5
SCHEMBL27794737 0.73 PPARA (0.48) MAPTALOX15ELANEHCAR2
SCHEMBL5164704 0.72 TLR8 (0.37) MAPTALOX15ELANESIRT2SMN1; SMN2
SCHEMBL27760838 0.72 TDP1 (0.51) MAPTMEN1KMT2ATDP1
SCHEMBL18889039 0.71 ALOX5 (0.50) MAPTALOX15CYP3A4ALOX5MEN1
SCHEMBL3923901 0.71 MAPT (0.42) MAPTALOX15ELANECYP3A4ALOX5

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
CN-117881658-A Two-step synthesis of pyrrole compounds from furan compounds 切弗朗菲利浦化学公司 2024-04-12 CN disclosed