SCHEMBL4237665

SCHEMBL4237665

Nc1nc2c(c(=O)[nH]1)NCC=N2

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 6/20 0.38
▸ PNP P00491 2/20 0.36
▸ QTRT1 Q9BXR0 1/20 0.35
▸ XDH P47989 1/20 0.35
▸ NOS3 P29474 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ DYRK1A Q13627 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PAH P00439 1/20 0.34

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
SCHEMBL4237669 0.72 CYP3A4 (0.32) —
SCHEMBL676634 0.72 KDM4E (0.43) NOS1PNPQTRT1XDHNOS3
7-Deazaguanine SCHEMBL26412 0.71 PNP (0.38) PNPQTRT1XDHDYRK1AHSD17B10
SCHEMBL8133897 0.66 NOS1 (0.33) NOS1PNPQTRT1XDHNOS3
SCHEMBL10064935 0.66 TYMS (0.41) NOS1PNPNOS3NOS2
SCHEMBL676635 0.66 CYP3A4 (0.32) —
SCHEMBL2523525 0.63 NOS1 (0.53) NOS1PNPNOS3NOS2DYRK1A
SCHEMBL3454164 0.63 NOS1 (0.53) NOS1PNPNOS3NOS2USP2
SCHEMBL8553212 0.63 PNP (0.41) NOS1PNPQTRT1DYRK1AHSD17B10
SCHEMBL6556237 0.63 PNP (0.41) NOS1PNPQTRT1DYRK1AHSD17B10

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
EP-1664317-B1 Use of precursor Z for the production of a means for therapy of human molybdenum cofactor deficiency ALEXION PHARMA INTERNAT SARL (CH) 2013-03-06 — — EP disclosed
US-7504095-B2 2,10-dioxo,2,12,12-trihydroxy,8-amino-4,4a,5a,6,9,10,11,11a,12,12a-decahydropterino(6',7':5,6)pyrano(2,3-d)-1,3,2-dioxaphosphorin TECHNISCHE UNIVERSITAET BRAUNSCHWEIG (DE) 2009-03-17 — — US disclosed
US-20070037250-A1 2,10-dioxo,2,12,12-trihydroxy,8-amino-4,4a,5a,6,9,10,11,11a,12,12a-decahydropterino(6',7':5,6)pyrano(2,3-d)-1,3,2-dioxaphosphorin PHOENIX TISSUE REPAIR, INC. 2007-02-15 — — US disclosed
EP-1664317-A2 METHOD FOR OBTAINING PRECURSOR Z AND USE THEREOF FOR THE PRODUCTION OF A MEANS FOR THERAPY OF HUMAN MOLYBDENUM COFACTOR DEFICIENCY Schwarz, Guenter (DE) 2006-06-07 — — EP disclosed
WO-2005073387-A2 METHOD FOR OBTAINING PRECURSOR Z AND USE THEREOF FOR THE PRODUCTION OF A MEANS FOR THERAPY OF HUMAN MOLYBDENUM COFACTOR DEFICIENCY SCHWARZ GUENTER (DE) 2005-08-11 — — WO disclosed
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