SCHEMBL6850680

SCHEMBL6850680

NC1(P(=O)(O)O)C=CC=C(c2ccccc2O)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
BCL2L1 Q07817 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6851099 0.75 PTPN1 (0.31) ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL4336208 0.75 ALDH1A1 (0.34) ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL28418518 0.71 POLB (0.33) ALDH1A1HPGDHSD17B10
SCHEMBL6851030 0.69 CA2 (0.33)
SCHEMBL6852957 0.66 ALDH1A1 (0.31) ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL28106479 0.66 KDM4E (0.33) ALDH1A1HPGDBCL2L1HSD17B10
Phosphoric Acid SCHEMBL31187365 0.64 ALDH1A1 (0.52) PTPN5ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL11074497 0.62 ALDH1A1 (0.41) ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL7551777 0.61 ALDH1A1 (0.33) ALDH1A1HPGDHSD17B10
SCHEMBL28856005 0.61 HSD17B10 (0.40) ALDH1A1HPGDBCL2L1HSD17B10

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