SCHEMBL8501394

SCHEMBL8501394

O=S(=O)(Oc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1-c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MAPT P10636 2/20 0.34
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALPL P05186 1/20 0.34
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
ANPEP P15144 2/20 0.33
IL1RN P18510 1/20 0.33
ERAP2 Q6P179 1/20 0.33
ERAP1 Q9NZ08 1/20 0.33
PNMT P11086 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS2 P35354 2/20 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
SCHEMBL7461046 0.87 ALPL (0.41) ALDH1A1MAPTMETAP2METAP1L3MBTL1
SCHEMBL8500027 0.85 CYP1A2 (0.40) ALDH1A1MAPTALPLSMN1; SMN2NPC1
SCHEMBL8499639 0.77 ALPL (0.40) ALDH1A1MAPTALPLCA12CA2
SCHEMBL577450 0.77 SLC6A9 (0.45) ALDH1A1SMN1; SMN2RAB9APNMTKDM4E
SCHEMBL8501253 0.75 MEN1 (0.48) ALDH1A1MAPTNPC1RAB9AKDM4E
SCHEMBL29216759 0.75 SLC6A9 (0.44) ALDH1A1KDM4EMEN1KMT2A
Sulfuric Acid SCHEMBL27766274 0.74 NPC1 (0.46) ALDH1A1NPC1RAB9AANPEPIL1RN
SCHEMBL28928665 0.74 PNMT (0.50) NPC1RAB9AANPEPIL1RNERAP2
SCHEMBL70992 0.74 PNMT (0.53) NPC1RAB9AANPEPIL1RNERAP2
SCHEMBL29809707 0.74 PNMT (0.53) NPC1RAB9AANPEPIL1RNERAP2

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
EP-0956312-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR Corporation (JP) 1999-11-17 EP disclosed
WO-1998033836-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR CORPORATION (JP) 1998-08-06 WO disclosed