SCHEMBL2346803

SCHEMBL2346803

Cc1cccc(P(=O)=O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TRPA1 O75762 2/20 0.50
KDM4E B2RXH2 2/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
KMT2A Q03164 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
ATM Q13315 2/20 0.39
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
ELANE P08246 2/20 0.34
CTSG P08311 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 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
SCHEMBL5595990 0.79 ALDH1A1 (0.59) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL64141 0.74
SCHEMBL2500374 0.74 ALDH1A1 (1.00) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL11575272 0.74 ALDH1A1 (1.00) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL5596935 0.74 ALDH1A1 (0.52) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL5596243 0.74 ALDH1A1 (0.52) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL5596510 0.74 ALDH1A1 (0.52) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL5596048 0.74 ALDH1A1 (0.52) ALDH1A1TRPA1KDM4EHPGDHSD17B10
SCHEMBL5596906 0.72 ALDH1A1 (0.50) ALDH1A1TRPA1KDM4EHPGDHSD17B10
Formaldehyde SCHEMBL11059015 0.72 ALDH1A1 (0.82) ALDH1A1TRPA1KDM4EHPGDHSD17B10

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
US-8008411-B2 Proton-conductive material, proton-conductive electrolyte for fuel cell comprising the material and fuel cell employing the electrolyte SAMSUNG SDI CO., LTD. (KR) 2011-08-30 US disclosed
US-20070259239-A1 PROTON-CONDUCTIVE MATERIAL, PROTON-CONDUCTIVE ELECTROLYTE FOR FUEL CELL COMPRISING THE MATERIAL AND FUEL CELL EMPLOYING THE ELECTROLYTE SAMSUNG SDI CO., LTD. (KR) 2007-11-08 US disclosed