SCHEMBL9583186

SCHEMBL9583186

Nc1nc2c(c(=O)[nH]1)NCN2C(OCCCO)OC(=O)CCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 7/20 0.41
▸ PNP P00491 1/20 0.31
▸ GART P22102 2/20 0.30
▸ XDH P47989 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
SCHEMBL9584094 0.93 HPRT1 (0.43) HPRT1PNPXDH
SCHEMBL9583518 0.93 HPRT1 (0.43) HPRT1PNPXDH
SCHEMBL9595040 0.92 HPRT1 (0.39) HPRT1PNPGART
SCHEMBL9583951 0.88 HPRT1 (0.40) HPRT1
SCHEMBL9583028 0.87 HPRT1 (0.41) HPRT1
SCHEMBL9584391 0.86 HPRT1 (0.43) HPRT1PNPXDH
SCHEMBL9582645 0.86 HPRT1 (0.38) HPRT1
SCHEMBL9584260 0.85 HPRT1 (0.42) HPRT1XDH
SCHEMBL9583338 0.84 HPRT1 (0.41) HPRT1XDH
SCHEMBL9582553 0.84 HPRT1 (0.36) HPRT1

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
US-5250535-A Herpes virus; nontoxic; side effect reduction; humans and veterinary medicine SYNTEX INC. (US) 1993-10-05 — — US claimed
EP-0085424-A2 Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl)purines as antiviral agent SYNTEX (U.S.A.) INC. (US) 1983-08-10 — — EP claimed
US-5250535-A Herpes virus; nontoxic; side effect reduction; humans and veterinary medicine SYNTEX INC. (US) 1993-10-05 — — US disclosed
US-4803271-A Process for preparing guanine derivatives SYNTEX (U.S.A.) INC. (US) 1989-02-07 — — US disclosed
US-4612314-A Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl) purines as antiviral agent SYNTEX (U.S.A.) INC. (US) 1986-09-16 — — US disclosed
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