SCHEMBL18486607

SCHEMBL18486607

CC(C)Cc1ccccc1[PH](=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
ELANE P08246 1/20 0.33
CTSG P08311 1/20 0.33
MAPT P10636 1/20 0.32
CRHBP P24387 1/20 0.32
RAB9A P51151 1/20 0.32
CRHR2 Q13324 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.31
ALB P02768 1/20 0.31
ESR1 P03372 1/20 0.31
ALOX5 P09917 1/20 0.31
RARB P10826 1/20 0.31

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
Phosphonic Acid SCHEMBL9001616 0.84 GABRA1 (0.56) GABRA1GABRB2ELANECTSGRAB9A
SCHEMBL575314 0.79 GABRA1 (0.44) GABRA1GABRB2MAPTNPSR1ALDH1A1
SCHEMBL28931114 0.79 KMT2A (0.53) PTGS1
SCHEMBL6549527 0.75 APOBEC3G (0.41) ALDH1A1HPGDTSHRLMNA
SCHEMBL969340 0.74 DAO (0.36) GABRA1GABRB2
Hydrogen Peroxide SCHEMBL5685702 0.74 GABRA1 (0.65) GABRA1GABRB2LMNAALBESR1
SCHEMBL21642989 0.74 APOBEC3G (0.40) ALDH1A1HPGDTSHRLMNA
SCHEMBL8898555 0.74 PNMT (0.41)
SCHEMBL840750 0.73 GABRA1 (0.64) GABRA1GABRB2LMNA
Bicarbonate SCHEMBL27568192 0.73 GABRA1 (0.58) GABRA1GABRB2RAB9ATSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10103401-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2018-10-16 US disclosed
EP-3131145-B1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME TORAY INDUSTRIES (JP) 2018-09-05 EP disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
EP-3131145-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME Toray Industries, Inc. (JP) 2017-02-15 EP disclosed