SCHEMBL9288196

SCHEMBL9288196

CC=Cc1ccc(O)c(CCCC)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.53
TYR P14679 3/20 0.47
IAPP P10997 3/20 0.45
APP P05067 7/20 0.43
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL1823337 0.86 TYR (0.50) TYRIAPPAPPPTGS1PTGS2
SCHEMBL1823336 0.86 TYR (0.50) TYRIAPPAPPPTGS1PTGS2
SCHEMBL1823735 0.85 TYR (0.53) TYRIAPPAPPPTGS1PTGS2
SCHEMBL1823738 0.85 TYR (0.53) TYRIAPPAPPPTGS1PTGS2
SCHEMBL28738043 0.82 CNR2 (0.60) CNR2TYRIAPPPTGS1PTGS2
SCHEMBL19337400 0.82 CNR2 (0.60) CNR2TYRIAPPPTGS1PTGS2
SCHEMBL5375049 0.81 TYR (0.47) TYRIAPPAPPMEN1TP53
SCHEMBL3430982 0.81 ALDH1A1 (0.50) TYRIAPPAPPPTGS2MEN1
SCHEMBL14359798 0.81 TYR (0.61) CNR2TYRIAPPAPPPTGS1
SCHEMBL1824859 0.81 TYR (0.53) TYRIAPPAPPPTGS1PTGS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7324153-A None JP disclosed
JP-H07324153-A TRANSPARENT STYRENE RESIN COMPOSITION TORAY IND INC 1995-12-12 JP disclosed