SCHEMBL7684224

SCHEMBL7684224

O=C(CCn1cnc2c(=O)[nH]cnc21)Nc1ccccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 11/20 0.49
PNP P00491 3/20 0.46
HCAR2 Q8TDS4 4/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C8 P10632 1/20 0.44

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
Hydrochloric Acid SCHEMBL7565171 0.82 HPRT1 (0.47) HPRT1
Leteprinim SCHEMBL358491 0.82 HPRT1 (0.50) HPRT1PNP
Leteprinim SCHEMBL6935182 0.81 HPRT1 (0.49) HPRT1PNP
Leteprinim SCHEMBL6931317 0.81 HPRT1 (0.49) HPRT1PNP
Leteprinim SCHEMBL194355 0.81 HPRT1 (0.49) HPRT1PNP
SCHEMBL8629196 0.80 HPRT1 (0.50) HPRT1PNP
Leteprinim SCHEMBL28734167 0.79 HPRT1 (0.47) HPRT1PNP
SCHEMBL7397072 0.78 HPRT1 (0.59) HPRT1PNP
SCHEMBL7374581 0.78 HPRT1 (0.64) HPRT1PNP
SCHEMBL7391120 0.76 HPRT1 (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001036419-A9 USE OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES TO STIMULATE REGENERATION OF NERVOUS TISSUE NEOTHERAPEUTICS INC (US) 2002-08-08 WO disclosed