SCHEMBL9713722

SCHEMBL9713722

O=S(=O)(c1ccc(O)c(-c2ccccc2)c1)c1ccc(O)c(-c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.56
PELI1 Q96FA3 1/20 0.53
GAA P10253 3/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
BCL2L1 Q07817 1/20 0.48
HSD17B10 Q99714 1/20 0.48
POLB P06746 2/20 0.44
GFER P55789 1/20 0.44
PTGS2 P35354 2/20 0.44
ALOX5 P09917 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
HTR6 P50406 1/20 0.43
MAOA P21397 2/20 0.42

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
SCHEMBL29429256 1.00 BACE1 (0.56) BACE1PELI1GAAMAPTALDH1A1
SCHEMBL1070330 1.00 BACE1 (0.56) BACE1PELI1GAAMAPTALDH1A1
SCHEMBL14760441 0.90 ESR1 (0.53) BACE1PELI1GAAMAPTALDH1A1
SCHEMBL8367520 0.87 BACE1 (0.54) BACE1PELI1ALDH1A1HPGDBCL2L1
SCHEMBL27871698 0.86 LMNA (0.50) BACE1PELI1GAAMAPTHPGD
SCHEMBL9545807 0.85 BACE1 (0.52) BACE1PELI1GAAMAPTALDH1A1
Dodecanol SCHEMBL9297161 0.84 TRPV1 (0.45) BACE1PELI1ALOX5MAOALOX
SCHEMBL9659575 0.83 PELI1 (0.46) BACE1PELI1GAAMAPTALDH1A1
SCHEMBL6906340 0.82 MAPT (0.52) GAAMAPTALDH1A1HPGDBCL2L1
SCHEMBL11045136 0.82 PTGS2 (0.53) MAPTALDH1A1POLBPTGS2CA12

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-1757634-B2 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER USING SAME IDEMITSU KOSAN CO (JP) 2022-05-25 EP claimed
EP-0249963-B1 POLYCARBONATES IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-04-22 EP claimed