SCHEMBL6849600

SCHEMBL6849600

O=C(O)c1cc(C(=O)O)cc(-c2ccccc2O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
HPGD P15428 4/20 0.56
HSD17B10 Q99714 3/20 0.56
BCL2L1 Q07817 1/20 0.56
DHODH Q02127 2/20 0.50
TSHR P16473 3/20 0.47
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
TTR P02766 2/20 0.47
MEN1 O00255 1/20 0.47
BCHE P06276 1/20 0.47
POLB P06746 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
CYP3A4 P08684 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL6851115 0.88 TPMT (0.52) ALDH1A1HPGDHSD17B10BCL2L1DHODH
SCHEMBL6851219 0.88 PTGER1 (0.56) ALDH1A1HPGDHSD17B10BCL2L1DHODH
SCHEMBL28409527 0.88 ALDH1A1 (0.47) ALDH1A1HPGDHSD17B10BCL2L1DHODH
SCHEMBL28409543 0.88 ALDH1A1 (0.47) ALDH1A1HPGDHSD17B10BCL2L1DHODH
SCHEMBL29908924 0.87 DHODH (0.57) DHODHTSHRTTRPOLBKMT2A
SCHEMBL29908910 0.85 DHODH (0.55) DHODHTSHRTTRPOLBKMT2A
SCHEMBL442496 0.85 KMO (0.63) ALDH1A1HPGDHSD17B10BCL2L1KMO
SCHEMBL9609308 0.84 TSHR (0.57) ALDH1A1HPGDHSD17B10BCL2L1DHODH
Hydrochloric Acid SCHEMBL27574419 0.83 KMO (0.61) ALDH1A1HPGDHSD17B10BCL2L1KMO
2-Phenylphenol SCHEMBL9013767 0.82 ALDH1A1 (0.71) ALDH1A1HPGDHSD17B10BCL2L1TSHR

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
EP-1294378-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2004-01-28 EP disclosed
EP-1294378-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-26 EP disclosed
WO-2001089457-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-29 WO disclosed