SCHEMBL7399237

SCHEMBL7399237

O=C(CCn1cnc2c(=O)[nH]cnc21)NCCN(OCCO)OCCO

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 19/20 0.48
PNP P00491 1/20 0.43

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
SCHEMBL7574815 0.87 BLM (0.57) HPRT1PNP
SCHEMBL7400125 0.86 HPRT1 (0.50) HPRT1PNP
SCHEMBL7399609 0.85 HPRT1 (0.56) HPRT1PNP
SCHEMBL7397424 0.83 HPRT1 (0.54) HPRT1PNP
SCHEMBL7402410 0.81 HPRT1 (0.57) HPRT1PNP
SCHEMBL7398541 0.80 HPRT1 (0.55) HPRT1PNP
SCHEMBL7399531 0.80 HPRT1 (0.55) HPRT1PNP
SCHEMBL7392166 0.79 HPRT1 (0.54) HPRT1PNP
SCHEMBL7398951 0.78 HPRT1 (0.54) HPRT1PNP
SCHEMBL9535314 0.78 HPRT1 (0.53) HPRT1PNP

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-0522082-B1 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE GLASKY ALVIN J (US) 1997-07-02 EP disclosed
US-5091432-A Synergistic SPECTRUM PHARMACEUTICALS, INC. 1992-02-25 US disclosed
WO-1991014434-A1 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE GLASKY ALVIN J (US) 1991-10-03 WO disclosed