SCHEMBL6893233

SCHEMBL6893233

CCCCCCCCCCCCCCCCCCOCCOC(=O)P(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
LPAR3 Q9UBY5 5/20 0.48
LPAR1 Q92633 4/20 0.48
LPAR2 Q9HBW0 2/20 0.48
CES2 O00748 2/20 0.47
LPAR5 Q9H1C0 1/20 0.45
TSHR P16473 2/20 0.44
NAAA Q02083 1/20 0.44
CYP3A4 P08684 1/20 0.44
DGKA P23743 1/20 0.44
PLA2G2A P14555 1/20 0.43
EPHX1 P07099 1/20 0.42

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
SCHEMBL4479861 0.93 LPAR3 (0.48) MEN1THRBHTTKMT2AMAPT
SCHEMBL27430832 0.89 LPAR3 (0.55) LPAR3LPAR1LPAR2TSHRNAAA
SCHEMBL6739566 0.89 LPAR3 (0.55) LPAR3LPAR1LPAR2TSHRNAAA
SCHEMBL6733974 0.89 LPAR3 (0.55) LPAR3LPAR1LPAR2TSHRNAAA
SCHEMBL6734330 0.89 LPAR3 (0.55) LPAR3LPAR1LPAR2TSHRNAAA
Phosphoric Acid SCHEMBL9775484 0.82 MEN1 (0.64) MEN1THRBHTTKMT2AMAPT
Phosphoric Acid SCHEMBL9775469 0.82 MEN1 (0.64) MEN1THRBHTTKMT2AMAPT
Phosphoric Acid SCHEMBL9775464 0.82 MEN1 (0.64) MEN1THRBHTTKMT2AMAPT
Phosphoric Acid SCHEMBL10667393 0.82 MEN1 (0.64) MEN1THRBHTTKMT2AMAPT
Phosphoric Acid SCHEMBL10901069 0.82 MEN1 (0.64) MEN1THRBHTTKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792275-B1 IMPROVED ANTIVIRAL PRODRUGS UNIV CALIFORNIA (US) 2004-03-03 EP disclosed
US-6002029-A Antiviral prodrugs CHIMERIX, INC. 1999-12-14 US disclosed
EP-0792275-A4 IMPROVED ANTIVIRAL PRODRUGS UNIV CALIFORNIA (US) 1998-02-25 EP disclosed
US-5696277-A CYTOMEGALOVIRUS, HERPES VIRUS Hostetler, Karl Y. (US) 1997-12-09 US disclosed
EP-0792275-A1 IMPROVED ANTIVIRAL PRODRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-09-03 EP disclosed
WO-1996015132-A1 IMPROVED ANTIVIRAL PRODRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-05-23 WO disclosed