Phosphonic Acid

Phosphonic Acid

SCHEMBL8955906

CC(=O)c1ccccc1C.O=[PH](O)O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TYK2 P29597 1/20 0.44
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
BRPF1 P55201 1/20 0.42
MYC P01106 1/20 0.41
DHODH Q02127 1/20 0.41
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41

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
SCHEMBL29441418 0.91 HPGD (0.57) HPGDSMN1; SMN2TYK2ERCC5FEN1
SCHEMBL112406 0.91 HPGD (0.57) HPGDSMN1; SMN2TYK2ERCC5FEN1
Bromide SCHEMBL29360866 0.89 HPGD (0.55) HPGDSMN1; SMN2TYK2ERCC5FEN1
O-Xylene SCHEMBL30657210 0.78 TSHR (0.62) HPGDALDH1A1KDM4EHSD17B10NPC1
O-Xylene SCHEMBL125242 0.78 TSHR (0.62) HPGDALDH1A1KDM4EHSD17B10NPC1
O-Xylene SCHEMBL28408327 0.78 TSHR (0.62) HPGDALDH1A1KDM4EHSD17B10NPC1
SCHEMBL28739353 0.76 HPGD (0.47) HPGDSMN1; SMN2TYK2ERCC5FEN1
SCHEMBL279655 0.75 ALDH1A1 (0.53) HPGDSMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL734717 0.75 HPGD (0.50) HPGDSMN1; SMN2TYK2ERCC5FEN1
SCHEMBL29087835 0.74 MYC (0.50) HPGDSMN1; SMN2TYK2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5538978-A NUCLEOSIDE PHOSPHORYLASE INHIBITORS AS IMMUNOSUPPRESSANTS, ANTILYMPHOMA, ANTILEUKEMIA, VIRICIDES AND ANTIPROTOZOA AGENTS MERRELL PHARMACEUTICALS INC. (US) 1996-07-23 US disclosed
US-5527803-A IMMUNOSUPPRESSANTS, PHOSPHORYLASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1996-06-18 US disclosed
US-5494912-A 9-purinyl phosphonic acid derivitives for treating gout MERRELL PHARMACEUTICALS INC. (US) 1996-02-27 US disclosed
EP-0465297-B1 9-Purinyl phosphonic acid derivatives MERRELL DOW PHARMA (US) 1996-01-31 EP disclosed
EP-0465297-A1 9-Purinyl phosphonic acid derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-01-08 EP disclosed