SCHEMBL29404702

SCHEMBL29404702

C=C(C)C(=O)OCCCCCCCCc1cc(C)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 2/20 0.37
KDM4E B2RXH2 3/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TNKS2 Q9H2K2 1/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL93349 1.00 POLB (0.38) POLBTDP1APEX1HTTNPC1
SCHEMBL7268054 0.96 NPC1 (0.39) POLBTDP1APEX1HTTNPC1
SCHEMBL4445599 0.92 NPC1 (0.40) POLBTDP1NPC1RAB9AALDH1A1
SCHEMBL7737490 0.88 POLB (0.35) POLBTDP1APEX1HTTNPC1
SCHEMBL6862719 0.87 POLB (0.36) POLBTDP1APEX1HTTNPC1
SCHEMBL14577752 0.87 NPC1 (0.36) POLBTDP1APEX1HTTNPC1
SCHEMBL5200144 0.86 ALDH1A1 (0.38) POLBTDP1NPC1RAB9AALDH1A1
SCHEMBL29729822 0.86 ALDH1A1 (0.38) POLBTDP1NPC1RAB9AALDH1A1
SCHEMBL692084 0.86 LMNA (0.43) POLBTDP1APEX1HTTNPC1
SCHEMBL29384533 0.86 LMNA (0.43) POLBTDP1APEX1HTTNPC1

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
CN-115917108-A Laminated glass and method for producing laminated glass AGC株式会社 2023-04-04 CN disclosed
WO-2022039089-A1 LAMINATED GLASS, AND METHOD FOR MANUFACTURING LAMINATED GLASS AGC株式会社 2022-02-24 WO disclosed