SCHEMBL29384286

SCHEMBL29384286

C=C(C)C(=O)OCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
ALDH1A1 P00352 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 3/20 0.36
F2R P25116 1/20 0.34
GAA P10253 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 4/20 0.34
MAOB P27338 2/20 0.34
MAOA P21397 1/20 0.34
HPGD P15428 4/20 0.33
MAPT P10636 4/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
TDP1 Q9NUW8 3/20 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
SCHEMBL93408 1.00 NPC1 (0.37) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL29384951 0.90 GAA (0.37) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL110871 0.90 GAA (0.37) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL1973788 0.89 RXFP1 (0.33) NPC1RAB9AALDH1A1GAAKDM4E
SCHEMBL3880166 0.88 GAA (0.36) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL29716387 0.88 GAA (0.36) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL6862719 0.86 POLB (0.36) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL13228157 0.86 GAA (0.39) NPC1RAB9AALDH1A1SMN1; SMN2GAA
SCHEMBL21808905 0.85 GAA (0.38) NPC1RAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL30254806 0.85 NPC1 (0.38) NPC1RAB9AALDH1A1SMN1; SMN2POLB

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 3 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
WO-2022030582-A1 LAMINATED GLASS AGC株式会社 2022-02-10 WO disclosed