SCHEMBL4361085

SCHEMBL4361085

CC(O)C(O)c1cnc2nc(N)nc(O)c2n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
PIK3CG P48736 4/20 0.35
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
DHFR P00374 1/20 0.32
APLNR P35414 1/20 0.32
ADORA2A P29274 1/20 0.32
NOS1 P29475 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
SCHEMBL258467 0.88 HSD17B10 (0.39) HSD17B10PIK3CGAPLNR
Hydrochloric Acid SCHEMBL8575908 0.87 HSD17B10 (0.39) HSD17B10PIK3CGAPLNR
SCHEMBL23028961 0.86 HSD17B10 (0.49) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6
SCHEMBL7761455 0.86 HSD17B10 (0.49) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6
SCHEMBL25899100 0.86 HSD17B10 (0.39) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6
SCHEMBL1524830 0.83 HSD17B10 (0.36) HSD17B10PIK3CG
SCHEMBL11301495 0.82 HSD17B10 (0.38) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6
SCHEMBL5608021 0.81 HSD17B10 (0.45) HSD17B10PIK3CAAPLNRNOS1
SCHEMBL9201051 0.79 HSD17B10 (0.38) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6
SCHEMBL11628253 0.79 PIK3CG (0.35) HSD17B10PIK3CGPIK3CAPIK3CBHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56099484-A None JP disclosed
US-20090286802-A1 High Dose Folic Acid Compositions for Vascular Dysfunction NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-11-19 US disclosed
EP-1874386-A1 HIGH DOSE FOLIC ACID COMPOSITIONS FOR VASCULAR DYSFUNCTION THE GENERAL HOSPITAL CORPORATION (US) 2008-01-09 EP disclosed
WO-2006113389-A1 HIGH DOSE FOLIC ACID COMPOSITIONS FOR VASCULAR DYSFUNCTION THE GENERAL HOSPITAL CORPORATION (US) 2006-10-26 WO disclosed
JP-2005015417-A ANTIFATIGUE COMPOSITION SOGO IKAGAKU KENKYUSHO:KK 2005-01-20 JP disclosed
EP-0370960-A1 Neopterin as a marker in a diagnostic screening test kit to detect retrovirus diseases Pera, Ivo E. (US) 1990-05-30 EP disclosed
US-4371514-A Radioimmunoassay of pterins and novel pterin derivatives useful therefor DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1983-02-01 US disclosed
JP-S5699484-A PTERIN DERIVATIVE AND DETERMINATION OF PTERINS DAIICHI RAJIO ISOTOPE KENKYUSHO:KK 1981-08-10 JP disclosed